2-benzyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
2-benzyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-7-oxoazepane-2-carboxamide
2-benzyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S515-0663 |
| Compound Name: | 2-benzyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C20 H26 N4 O2 |
| Smiles: | Cc1c(CNC(C2(CCCCC(N2)=O)Cc2ccccc2)=O)c(C)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0629 |
| logD: | 2.0629 |
| logSw: | -2.6003 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.67 |
| InChI Key: | RTORTOVAEQTAQJ-HXUWFJFHSA-N |