4-[2-(diethylcarbamoyl)-4-(3-methylbutanamido)phenyl]-N-(propan-2-yl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[2-(diethylcarbamoyl)-4-(3-methylbutanamido)phenyl]-N-(propan-2-yl)-1,4-diazepane-1-carboxamide
4-[2-(diethylcarbamoyl)-4-(3-methylbutanamido)phenyl]-N-(propan-2-yl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V025-1046 |
| Compound Name: | 4-[2-(diethylcarbamoyl)-4-(3-methylbutanamido)phenyl]-N-(propan-2-yl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 459.63 |
| Molecular Formula: | C25 H41 N5 O3 |
| Smiles: | CCN(CC)C(c1cc(ccc1N1CCCN(CC1)C(NC(C)C)=O)NC(CC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4666 |
| logD: | 3.4523 |
| logSw: | -3.7995 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.647 |
| InChI Key: | SPYOPBPBHCBWQX-UHFFFAOYSA-N |