[1-(4-chlorobenzene-1-sulfonyl)pyrrolidin-2-yl]{3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone
Chemical Structure Depiction of
[1-(4-chlorobenzene-1-sulfonyl)pyrrolidin-2-yl]{3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone
[1-(4-chlorobenzene-1-sulfonyl)pyrrolidin-2-yl]{3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone
Compound characteristics
| Compound ID: | 4554-3497 |
| Compound Name: | [1-(4-chlorobenzene-1-sulfonyl)pyrrolidin-2-yl]{3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-1-yl}methanone |
| Molecular Weight: | 490.04 |
| Molecular Formula: | C23 H24 Cl N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)Sc1c(C)nn(C(C2CCCN2S(c2ccc(cc2)[Cl])(=O)=O)=O)c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2496 |
| logD: | 4.2495 |
| logSw: | -4.4657 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.129 |
| InChI Key: | NULYKEMZLIEFOA-NRFANRHFSA-N |