4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide
4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V025-4508 |
| Compound Name: | 4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 623.68 |
| Molecular Formula: | C33 H36 F3 N5 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(Nc1ccc(c(c1)C(N1CCCCC1)=O)N1CCCN(CC1)C(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9047 |
| logD: | 5.9007 |
| logSw: | -5.5594 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.281 |
| InChI Key: | XXNLMVCRHGZAAH-UHFFFAOYSA-N |