N-tert-butyl-4-[4-(ethylcarbamamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-[4-(ethylcarbamamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
N-tert-butyl-4-[4-(ethylcarbamamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V004-2700 |
| Compound Name: | N-tert-butyl-4-[4-(ethylcarbamamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 472.63 |
| Molecular Formula: | C25 H40 N6 O3 |
| Smiles: | CCNC(Nc1ccc(c(c1)C(N1CCCCC1)=O)N1CCCN(CC1)C(NC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4379 |
| logD: | 3.4236 |
| logSw: | -3.7352 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.586 |
| InChI Key: | STNIQARLGOLSID-UHFFFAOYSA-N |