N-(butan-2-yl)-4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
N-(butan-2-yl)-4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V009-2807 |
| Compound Name: | N-(butan-2-yl)-4-chloro-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 524.04 |
| Molecular Formula: | C28 H31 Cl F N5 O2 |
| Salt: | not_available |
| Smiles: | CCC(C)N(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0583 |
| logD: | 5.0564 |
| logSw: | -5.2296 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.696 |
| InChI Key: | YQUPFFRLDIBHGG-FQEVSTJZSA-N |