ethyl 5-amino-1-[4-(azepane-1-carbonyl)phenyl]-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-amino-1-[4-(azepane-1-carbonyl)phenyl]-1H-pyrazole-4-carboxylate
ethyl 5-amino-1-[4-(azepane-1-carbonyl)phenyl]-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-0004 |
| Compound Name: | ethyl 5-amino-1-[4-(azepane-1-carbonyl)phenyl]-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 356.42 |
| Molecular Formula: | C19 H24 N4 O3 |
| Smiles: | CCOC(c1cnn(c2ccc(cc2)C(N2CCCCCC2)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7253 |
| logD: | 2.7253 |
| logSw: | -2.9482 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.287 |
| InChI Key: | LNHBRDJIQVQSDP-UHFFFAOYSA-N |