N-{6-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea
Chemical Structure Depiction of
N-{6-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea
N-{6-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea
Compound characteristics
| Compound ID: | V017-3261 |
| Compound Name: | N-{6-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(2,3-dimethylphenyl)urea |
| Molecular Weight: | 477.99 |
| Molecular Formula: | C26 H28 Cl N5 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1C)NC(Nc1ccc(nc1)N1CCCN(CC1)C(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8159 |
| logD: | 5.8158 |
| logSw: | -6.0491 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.684 |
| InChI Key: | KYSYBSOAYLCRDB-UHFFFAOYSA-N |