2-chloro-N-{4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}benzamide
Chemical Structure Depiction of
2-chloro-N-{4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}benzamide
2-chloro-N-{4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}benzamide
Compound characteristics
| Compound ID: | V025-6079 |
| Compound Name: | 2-chloro-N-{4-[4-(2-phenylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}benzamide |
| Molecular Weight: | 587.16 |
| Molecular Formula: | C34 H39 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCCN(CC1)c1ccc(cc1C(N1CCCCC1)=O)NC(c1ccccc1[Cl])=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0721 |
| logD: | 6.0712 |
| logSw: | -5.9053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.917 |
| InChI Key: | IHAQVSADSOWRMS-HHHXNRCGSA-N |