ethyl 5-amino-1-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-amino-1-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
ethyl 5-amino-1-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-0242 |
| Compound Name: | ethyl 5-amino-1-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C21 H29 N5 O3 |
| Smiles: | CCOC(c1cnn(c2ccc(cc2)C(NCCN2CCCCCC2)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4894 |
| logD: | 1.5127 |
| logSw: | -2.7826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.877 |
| InChI Key: | LTNVCVDOSPOLMS-UHFFFAOYSA-N |