2-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-(3-methylbutanamido)benzamide
Chemical Structure Depiction of
2-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-(3-methylbutanamido)benzamide
2-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-(3-methylbutanamido)benzamide
Compound characteristics
| Compound ID: | V005-4173 |
| Compound Name: | 2-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-5-(3-methylbutanamido)benzamide |
| Molecular Weight: | 442.6 |
| Molecular Formula: | C25 H38 N4 O3 |
| Smiles: | CCN(CC)C(c1cc(ccc1N1CCCN(CC1)C(C1CC1)=O)NC(CC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3281 |
| logD: | 3.3277 |
| logSw: | -3.7012 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.782 |
| InChI Key: | PMPQCWSNYVIDNY-UHFFFAOYSA-N |