3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl cyclopentanecarboxylate
Chemical Structure Depiction of
3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl cyclopentanecarboxylate
3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl cyclopentanecarboxylate
Compound characteristics
| Compound ID: | C100-0274 |
| Compound Name: | 3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl cyclopentanecarboxylate |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C23 H24 N2 O2 S |
| Smiles: | Cc1ccc(cc1)Sc1c(C)nn(c2ccccc2)c1OC(C1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7956 |
| logD: | 5.7956 |
| logSw: | -5.4432 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.837 |
| InChI Key: | ABTBQNGHJJVYNH-UHFFFAOYSA-N |