ethyl 5-amino-1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}phenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-amino-1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}phenyl)-1H-pyrazole-4-carboxylate
ethyl 5-amino-1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}phenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-0035 |
| Compound Name: | ethyl 5-amino-1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}phenyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 477.52 |
| Molecular Formula: | C25 H27 N5 O5 |
| Smiles: | CCOC(c1cnn(c2ccc(cc2)C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4169 |
| logD: | 2.2253 |
| logSw: | -2.8638 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.612 |
| InChI Key: | ZAKFHUFAPILINV-UHFFFAOYSA-N |