ethyl 5-amino-1-(4-{[3-(azepan-1-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-amino-1-(4-{[3-(azepan-1-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
ethyl 5-amino-1-(4-{[3-(azepan-1-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-0239 |
| Compound Name: | ethyl 5-amino-1-(4-{[3-(azepan-1-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C22 H31 N5 O3 |
| Smiles: | CCOC(c1cnn(c2ccc(cc2)C(NCCCN2CCCCCC2)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6126 |
| logD: | 0.0419 |
| logSw: | -2.9436 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.877 |
| InChI Key: | LMXZBJWOAHVDTP-UHFFFAOYSA-N |