1-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(4-methylphenyl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(4-methylphenyl)sulfanyl]ethan-1-one
1-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(4-methylphenyl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 5311-0253 |
| Compound Name: | 1-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(4-methylphenyl)sulfanyl]ethan-1-one |
| Molecular Weight: | 476.59 |
| Molecular Formula: | C27 H28 N2 O4 S |
| Smiles: | [H]C(C(N1C(CC(c2ccc(cc2)OC)=N1)c1cccc(c1OC)OC)=O)Sc1ccc(C)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8553 |
| logD: | 5.8553 |
| logSw: | -5.4937 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.478 |
| InChI Key: | HMMLFFBMXRZUNF-DEOSSOPVSA-N |