1-[4-(difluoromethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(5-fluoro-2-methoxyphenyl)urea
Structure Info
- Chemspace ID
- CSSB21332088934 (In-Stock Building Blocks)
- IUPAC Name
- 1-[4-(difluoromethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(5-fluoro-2-methoxyphenyl)urea
- Mol formula
- C21H24BF3N2O5
- Mol weight
- 452 Da
- Catalog Number(s)
- BBLS21332088934, EN300-54741890, bbls21332088934
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.85
- Heavy atoms count
- 32
- Rotatable bond count
- 6
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.38
- Polar surface area (Å)
- 78
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
![Chemical structure of 1-[4-(difluoromethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(5-fluoro-2-methoxyphenyl)urea (C21H24BF3N2O5) - CSSB21332088934](/st/structure/200/e78f7f087c92e050aa98ecf042dbd7b6/COC1%253DC%2528NC%2528%253DO%2529NC2%253DCC%2528B3OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O3%2529%253DC%2528OC%2528F%2529F%2529C%253DC2%2529C%253DC%2528F%2529C%253DC1.png "C21H24BF3N2O5")
- Zoom the structure
- CSSB21332088934
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 | 683.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 716.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 748.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 781.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 813.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,594.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 2,360.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 3,499.00 |
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Substructure Analogs
![Chemical structure of 3-[4-(difluoromethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1-(6-fluoro-2,4-dihydro-1,3-benzodioxin-8-yl)urea - CSSB21332134502](/st/structure/200/17dc9f02b82d7992da1c3846878bda07/CC1%2528C%2529OB%2528OC1%2528C%2529C%2529C1%253DC%2528OC%2528F%2529F%2529C%253DCC%2528NC%2528%253DO%2529NC2%253DC3OCOCC3%253DCC%2528F%2529%253DC2%2529%253DC1.png)