3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl furan-2-carboxylate
Chemical Structure Depiction of
3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl furan-2-carboxylate
3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | C100-0349 |
| Compound Name: | 3-methyl-4-[(4-methylphenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl furan-2-carboxylate |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C22 H18 N2 O3 S |
| Smiles: | Cc1ccc(cc1)Sc1c(C)nn(c2ccccc2)c1OC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.868 |
| logD: | 4.868 |
| logSw: | -4.7352 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.857 |
| InChI Key: | DFZBKBSYVXNTGG-UHFFFAOYSA-N |