N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea
Chemical Structure Depiction of
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea
Compound characteristics
| Compound ID: | V021-6274 |
| Compound Name: | N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea |
| Molecular Weight: | 512.44 |
| Molecular Formula: | C26 H27 Cl2 N5 O2 |
| Smiles: | Cc1cccc(c1C)NC(Nc1ccc(nc1)N1CCCN(CC1)C(c1ccc(cc1[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3554 |
| logD: | 6.3553 |
| logSw: | -6.2177 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.684 |
| InChI Key: | JYDVRARMNQFSTA-UHFFFAOYSA-N |