1-[1-(4-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-[1-(4-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide
1-[1-(4-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E751-4688 |
| Compound Name: | 1-[1-(4-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C27 H26 F N5 O2 S |
| Smiles: | CSc1cccc(c1)NC(C1CCCN(C1)C(c1cnn(c2ccc(cc2)F)c1n1cccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.618 |
| logD: | 4.618 |
| logSw: | -4.2238 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.768 |
| InChI Key: | YRLLTSWQINPNBM-IBGZPJMESA-N |