4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V021-8014 |
| Compound Name: | 4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 526.01 |
| Molecular Formula: | C27 H29 Cl F N5 O3 |
| Salt: | not_available |
| Smiles: | COCCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4897 |
| logD: | 3.4878 |
| logSw: | -3.9887 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.689 |
| InChI Key: | TYQLWNTUVWKBJE-UHFFFAOYSA-N |