methyl {1-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}acetate
Chemical Structure Depiction of
methyl {1-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}acetate
methyl {1-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}acetate
Compound characteristics
| Compound ID: | Y040-9332 |
| Compound Name: | methyl {1-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperidin-4-yl}acetate |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C22 H23 N3 O3 S |
| Smiles: | COC(CC1CCN(CC1)C(c1cc(c2cccs2)nn1c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9803 |
| logD: | 3.9803 |
| logSw: | -4.1835 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.307 |
| InChI Key: | JBTAEQNNSPGXHO-UHFFFAOYSA-N |