[1-(4-bromobenzene-1-sulfonyl)pyrrolidin-2-yl][3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
[1-(4-bromobenzene-1-sulfonyl)pyrrolidin-2-yl][3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone
[1-(4-bromobenzene-1-sulfonyl)pyrrolidin-2-yl][3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone
Compound characteristics
| Compound ID: | 5795-0012 |
| Compound Name: | [1-(4-bromobenzene-1-sulfonyl)pyrrolidin-2-yl][3,5-dimethyl-4-(phenylsulfanyl)-1H-pyrazol-1-yl]methanone |
| Molecular Weight: | 520.47 |
| Molecular Formula: | C22 H22 Br N3 O3 S2 |
| Smiles: | Cc1c(c(C)n(C(C2CCCN2S(c2ccc(cc2)[Br])(=O)=O)=O)n1)Sc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8803 |
| logD: | 3.8803 |
| logSw: | -3.9492 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.129 |
| InChI Key: | GQVYTNJWCUAVBU-FQEVSTJZSA-N |