1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C883-0839 |
| Compound Name: | 1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide |
| Molecular Weight: | 479.64 |
| Molecular Formula: | C26 H33 N5 O2 S |
| Smiles: | CCCSCCCNC(C1CCN(CC1)C(c1cnn(c2ccccc2)c1n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7533 |
| logD: | 3.7533 |
| logSw: | -3.6044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.27 |
| InChI Key: | JYHXUTNTQMYFNR-UHFFFAOYSA-N |