3-(2-chloro-3-methylphenyl)-1-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
Structure Info
- Chemspace ID
- CSSB21332139179 (In-Stock Building Blocks)
- IUPAC Name
- 3-(2-chloro-3-methylphenyl)-1-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
- Mol formula
- C21H26BClN2O3
- Mol weight
- 401 Da
- Catalog Number(s)
- BBLS21332139179, EN300-54962858, bbls21332139179
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 6.81
- Heavy atoms count
- 28
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.38
- Polar surface area (Å)
- 60
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
![Chemical structure of 3-(2-chloro-3-methylphenyl)-1-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea (C21H26BClN2O3) - CSSB21332139179](/st/structure/200/2bf57179f6a46bc8d0f6b8addb82a8bc/CC1%253DCC%253DCC%2528NC%2528%253DO%2529NC2%253DC%2528C%2529C%253DCC%2528%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC1Cl.png "C21H26BClN2O3")
- Zoom the structure
- CSSB21332139179
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 | 455.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 477.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 498.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 519.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 541.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,063.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 1,572.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 2,331.00 |
For a custom pack size or bulk
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Substructure Analogs
![Chemical structure of 3-(2,6-dichloro-3-methylphenyl)-1-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332091167](/st/structure/200/3231dd7480d0d59f46b1101d8ff91d9d/CC1%253DCC%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528C%2529C%253DCC%2528%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC1Cl.png)
![Chemical structure of 1-(2-chloro-3-methylphenyl)-3-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332058137](/st/structure/200/c4308baacaaee090c731fd3dae1388c5/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NC2%253DCC%253DCC%2528C%2529%253DC2Cl%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 1-[2-chloro-3-(trifluoromethyl)phenyl]-3-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332088527](/st/structure/200/1cf644cf55187a8a3ae7603108f4208c/CC1%253DC%2528NC%2528%253DO%2529NC2%253DC%2528Cl%2529C%2528%253DCC%253DC2%2529C%2528F%2529%2528F%2529F%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 1-(2,6-dichloro-3-methylphenyl)-3-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332090002](/st/structure/200/af38368a465fe14a5ac80c478ba8d80e/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NC2%253DC%2528Cl%2529C%253DCC%2528C%2529%253DC2Cl%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 1-[2-chloro-3-(trifluoromethyl)phenyl]-3-[2-(propan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332045982](/st/structure/200/7c5326a6ac2def7839cdd5f221ec324e/CC%2528C%2529C1%253DC%2528NC%2528%253DO%2529NC2%253DC%2528Cl%2529C%2528%253DCC%253DC2%2529C%2528F%2529%2528F%2529F%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
Similarity Analogs
![Chemical structure of 1-(2-chloro-3-fluorophenyl)-3-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332137069](/st/structure/200/013db8cf70fd00e07fb1d8e52a90ca69/CC1%253DC%2528NC%2528%253DO%2529NC2%253DC%2528Cl%2529C%2528F%2529%253DCC%253DC2%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 3-(2-chloro-3-methylphenyl)-1-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332142439](/st/structure/200/d481481cd6a6e0039b2fdc536263e30c/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528F%2529C%253DCC%2528%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DCC%253DC1.png)
![Chemical structure of 3-(2-chloro-3-methylphenyl)-1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332149134](/st/structure/200/fcb06a037bba38fd6d4f6eaa0e4129fa/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528F%2529C%253DC%2528C%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DCC%253DC1.png)
![Chemical structure of 1-(2,3-dichlorophenyl)-3-[2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332090070](/st/structure/200/5d7005f7de4210afe7cd0bfe64635209/CC1%253DC%2528NC%2528%253DO%2529NC2%253DC%2528Cl%2529C%2528Cl%2529%253DCC%253DC2%2529C%253DC%2528C%253DC1%2529B1OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O1.png)
![Chemical structure of 3-(2-chloro-3-methylphenyl)-1-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332156547](/st/structure/200/8cf84b7309e32ebef304d596c1b25fe6/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528Cl%2529C%253DC%2528C%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DCC%253DC1.png)
![Chemical structure of 3-(2-chloro-3-methylphenyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332161759](/st/structure/200/638a6a5f525936f588c1fcc332b79cf4/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DCC%253DC%2528C%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DCC%253DC1.png)
![Chemical structure of 3-(2-chloro-3-methylphenyl)-1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332144232](/st/structure/200/a16a3f7437974ea2353fbc135fc3fead/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DCC%2528%253DCC%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DCC%253DC1.png)
