N-[(7-oxoazepan-2-yl)methyl]-3-phenyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[(7-oxoazepan-2-yl)methyl]-3-phenyl-1H-pyrazole-4-carboxamide
N-[(7-oxoazepan-2-yl)methyl]-3-phenyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | S562-0084 |
| Compound Name: | N-[(7-oxoazepan-2-yl)methyl]-3-phenyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 312.37 |
| Molecular Formula: | C17 H20 N4 O2 |
| Smiles: | C1CCC(NC(C1)CNC(c1c[nH]nc1c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4542 |
| logD: | 1.4541 |
| logSw: | -2.269 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.925 |
| InChI Key: | YJAMSTLOWIRILI-CYBMUJFWSA-N |