3-(2,6-dichloro-3-methylphenyl)-1-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
Structure Info
- Chemspace ID
- CSSB21332089913 (In-Stock Building Blocks)
- IUPAC Name
- 3-(2,6-dichloro-3-methylphenyl)-1-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
- Mol formula
- C20H22BCl2FN2O3
- Mol weight
- 439 Da
- Catalog Number(s)
- BBLS21332089913, EN300-54747317, bbls21332089913
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 7
- Heavy atoms count
- 29
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.35
- Polar surface area (Å)
- 60
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
![Chemical structure of 3-(2,6-dichloro-3-methylphenyl)-1-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea (C20H22BCl2FN2O3) - CSSB21332089913](/st/structure/200/53320bd2479e93b65b1d44748e99dcaa/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528F%2529C%253DCC%2528%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC%2528Cl%2529C%253DC1.png "C20H22BCl2FN2O3")
- Zoom the structure
- CSSB21332089913
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 |
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Substructure Analogs
![Chemical structure of 1-[4-chloro-2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,6-dichloro-3-methylphenyl)urea - CSSB21332131062](/st/structure/200/263b5b633f2c40882ea546f80f45fb3e/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528F%2529C%253DC%2528Cl%2529C%2528%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC%2528Cl%2529C%253DC1.png)
Similarity Analogs
![Chemical structure of 3-(2,6-dichloro-3-methylphenyl)-1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332093783](/st/structure/200/8deed7990fbf6c05d8738c83da8d8ed8/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528F%2529C%253DC%2528C%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC%2528Cl%2529C%253DC1.png)
![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-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,6-dichloro-3-methylphenyl)urea - CSSB21332087929](/st/structure/200/b6781a15d94df66aafc848ba539f7683/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528Cl%2529C%253DC%2528C%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC%2528Cl%2529C%253DC1.png)
![Chemical structure of 3-(2,6-dichloro-3-methylphenyl)-1-[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332085526](/st/structure/200/edd1899d5d5ffe01081c7022e3d442dd/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DCC%2528F%2529%253DC%2528C%253DC2%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC%2528Cl%2529C%253DC1.png)
![Chemical structure of 3-(2,6-dichloro-3-methylphenyl)-1-[2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332089447](/st/structure/200/7eefeb4c6244fbdf55346e301607b79b/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528F%2529C%253DC%2528C%253DC2F%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC%2528Cl%2529C%253DC1.png)
![Chemical structure of 3-(2,6-dichloro-3-methylphenyl)-1-[2-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea - CSSB21332155739](/st/structure/200/e3c0f5d7b5fc38aaa77dcf3f28f65760/CC1%253DC%2528Cl%2529C%2528NC%2528%253DO%2529NC2%253DC%2528C%253DCC%253DC2F%2529B2OC%2528C%2529%2528C%2529C%2528C%2529%2528C%2529O2%2529%253DC%2528Cl%2529C%253DC1.png)
