N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(4-methoxyphenyl)urea
Chemical Structure Depiction of
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(4-methoxyphenyl)urea
N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(4-methoxyphenyl)urea
Compound characteristics
| Compound ID: | V021-7883 |
| Compound Name: | N-{6-[4-(2,4-dichlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-N'-(4-methoxyphenyl)urea |
| Molecular Weight: | 514.41 |
| Molecular Formula: | C25 H25 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)NC(Nc1ccc(nc1)N1CCCN(CC1)C(c1ccc(cc1[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7064 |
| logD: | 5.7063 |
| logSw: | -5.9883 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.926 |
| InChI Key: | MFYVQZJPNOEDKF-UHFFFAOYSA-N |