N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(2,6-dimethylphenyl)urea
Chemical Structure Depiction of
N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(2,6-dimethylphenyl)urea
N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(2,6-dimethylphenyl)urea
Compound characteristics
| Compound ID: | V024-4132 |
| Compound Name: | N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)-N'-(2,6-dimethylphenyl)urea |
| Molecular Weight: | 508.02 |
| Molecular Formula: | C27 H30 Cl N5 O3 |
| Smiles: | Cc1cccc(C)c1NC(Nc1ccc(nc1)N1CCCN(CC1)C(COc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1184 |
| logD: | 5.1181 |
| logSw: | -5.46 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.958 |
| InChI Key: | JYZOXAXGBXNZHX-UHFFFAOYSA-N |