N-tert-butyl-4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
N-tert-butyl-4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V013-9027 |
| Compound Name: | N-tert-butyl-4-[4-(3-methoxybenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 535.69 |
| Molecular Formula: | C30 H41 N5 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N1CCCN(CC1)c1ccc(cc1C(N1CCCCC1)=O)NC(c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5277 |
| logD: | 4.5134 |
| logSw: | -4.2647 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.699 |
| InChI Key: | KHLBQWKKHCYDTA-UHFFFAOYSA-N |