N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)-N'-(4-methylphenyl)urea
Chemical Structure Depiction of
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)-N'-(4-methylphenyl)urea
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)-N'-(4-methylphenyl)urea
Compound characteristics
| Compound ID: | V015-0593 |
| Compound Name: | N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)-N'-(4-methylphenyl)urea |
| Molecular Weight: | 537.06 |
| Molecular Formula: | C28 H33 Cl N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC(N(CCOC)CC(N1CCCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9261 |
| logD: | 3.92 |
| logSw: | -4.2046 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.51 |
| InChI Key: | FYYUHLFKYXFPPQ-UHFFFAOYSA-N |