4-[4-benzamido-2-(pyrrolidine-1-carbonyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[4-benzamido-2-(pyrrolidine-1-carbonyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
4-[4-benzamido-2-(pyrrolidine-1-carbonyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V028-1139 |
| Compound Name: | 4-[4-benzamido-2-(pyrrolidine-1-carbonyl)phenyl]-N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 541.65 |
| Molecular Formula: | C31 H35 N5 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)NC(N1CCCN(CC1)c1ccc(cc1C(N1CCCC1)=O)NC(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3894 |
| logD: | 4.3854 |
| logSw: | -4.2875 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.647 |
| InChI Key: | BRFVORHEGFTMCW-UHFFFAOYSA-N |