N-tert-butyl-4-[2-(diethylcarbamoyl)-4-propanamidophenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-[2-(diethylcarbamoyl)-4-propanamidophenyl]-1,4-diazepane-1-carboxamide
N-tert-butyl-4-[2-(diethylcarbamoyl)-4-propanamidophenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V006-2206 |
| Compound Name: | N-tert-butyl-4-[2-(diethylcarbamoyl)-4-propanamidophenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 445.61 |
| Molecular Formula: | C24 H39 N5 O3 |
| Salt: | not_available |
| Smiles: | CCC(Nc1ccc(c(c1)C(N(CC)CC)=O)N1CCCN(CC1)C(NC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9942 |
| logD: | 2.9799 |
| logSw: | -3.4375 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.497 |
| InChI Key: | IRXPDLXQJWHJLU-UHFFFAOYSA-N |