(2-bromophenyl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
(2-bromophenyl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
(2-bromophenyl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone
Compound characteristics
Compound ID: | G680-0247 |
Compound Name: | (2-bromophenyl)[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]methanone |
Molecular Weight: | 412.3 |
Molecular Formula: | C16 H18 Br N3 O3 S |
Smiles: | Cc1c(c(C)n(C(c2ccccc2[Br])=O)n1)S(N1CCCC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6442 |
logD: | 1.6442 |
logSw: | -2.5388 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 59.929 |
InChI Key: | YQCYSKOWWRRBCG-UHFFFAOYSA-N |