ethyl 4-[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperazine-1-carboxylate
ethyl 4-[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | G013-0479 |
| Compound Name: | ethyl 4-[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 411.43 |
| Molecular Formula: | C21 H22 F N5 O3 |
| Smiles: | CCOC(N1CCN(CC1)C(c1cnn(c2cccc(c2)F)c1n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3306 |
| logD: | 3.3306 |
| logSw: | -3.3627 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.523 |
| InChI Key: | CNADUFQSEDAWRH-UHFFFAOYSA-N |