3-butyl-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
Structure Info
- Chemspace ID
- CSSB20784836227 (In-Stock Building Blocks)
- IUPAC Name
- 3-butyl-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
- Mol formula
- C20H33BN2O3
- Mol weight
- 360 Da
- Catalog Number(s)
- BBLS20784836227, BBV-1661931424, EN300-54725321, bbls20784836227
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.6
- Heavy atoms count
- 26
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.65
- Polar surface area (Å)
- 60
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
![Chemical structure of 3-butyl-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea (C20H33BN2O3) - CSSB20784836227](/st/structure/200/160954cf4e9f8c25f6abf1fbb18b3cd0/CCCCNC%2528%253DO%2529NC1%253DCC%2528%253DCC%253DC1C%2528C%2529C%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png "C20H33BN2O3")
- Zoom the structure
- CSSB20784836227
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 924.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 968.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 1,012.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 1,056.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 1,100.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 2,155.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 3,189.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 4,729.00 |
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Substructure Analogs
![Chemical structure of 3-(cyclopropylmethyl)-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB20784021061](/st/structure/200/af17b5c77356db438d8e47af7070a0b1/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NCC2CC2%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 3-cyclobutyl-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB20784021056](/st/structure/200/9e4e7cad6a127f7164697fff97aedc09/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NC2CCC2%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 3-(2-methylcyclopropyl)-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB20784007353](/st/structure/200/7a7df9a6293eece8ca3d8bc2480ad7b1/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NC2CC2C%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 3-(2-methylbutyl)-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332086137](/st/structure/200/c9f629147f3b0007e5b0194eca42e54f/CCC%2528C%2529CNC%2528%253DO%2529NC1%253DC%2528C%253DCC%2528%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528C%2529C.png)
![Chemical structure of 3-(cyclobutylmethyl)-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332091431](/st/structure/200/e84c82ce29621063a2986c73e3d3625e/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NCC2CCC2%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 3-(2,2-dimethylcyclopropyl)-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332062856](/st/structure/200/7b55663185d9205bf0986ef2827ccf1b/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NC2CC2%2528C%2529C%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 3-(pent-4-en-1-yl)-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332151549](/st/structure/200/71f0693a095e389645da9e0f06b66797/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NCCCC%253DC%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
Similarity Analogs
![Chemical structure of 3-pentyl-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332090508](/st/structure/200/d6a95a1f99cbedaf249112fa60b720c0/CCCCCNC%2528%253DO%2529NC1%253DC%2528C%253DCC%2528%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528C%2529C.png)
![Chemical structure of 3-hexyl-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332092424](/st/structure/200/2053a8f14a5f9b1f909e1f026247480b/CCCCCCNC%2528%253DO%2529NC1%253DC%2528C%253DCC%2528%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528C%2529C.png)
![Chemical structure of 3-octyl-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332085594](/st/structure/200/41cc668aa97b93a1b0027c4bcf85bd97/CCCCCCCCNC%2528%253DO%2529NC1%253DC%2528C%253DCC%2528%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528C%2529C.png)
![Chemical structure of 1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-propylurea - CSSB20784021050](/st/structure/200/ca5dedc9ad48e39cd92285317a03d76f/CCCNC%2528%253DO%2529NC1%253DC%2528C%253DCC%2528%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528C%2529C.png)
![Chemical structure of 3-[3-(methylsulfanyl)propyl]-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332091432](/st/structure/200/2c27426cea2cb90a649b82172bfbda3e/CSCCCNC%2528%253DO%2529NC1%253DC%2528C%253DCC%2528%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528C%2529C.png)
![Chemical structure of 3-(3-ethoxypropyl)-1-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332090506](/st/structure/200/233f33e6808ec89ef441eea0cb7ad652/CCOCCCNC%2528%253DO%2529NC1%253DC%2528C%253DCC%2528%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1%2529C%2528C%2529C.png)
![Chemical structure of 1-(4-cyclohexylbutyl)-3-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332056999](/st/structure/200/011a11a82ee673b2d38ff9e18dccf145/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NCCCCC2CCCCC2%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
