2-(4-bromophenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-bromophenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one
2-(4-bromophenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one
Compound characteristics
Compound ID: | F897-0829 |
Compound Name: | 2-(4-bromophenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one |
Molecular Weight: | 469.4 |
Molecular Formula: | C19 H25 Br N4 O3 S |
Smiles: | CCn1c(C)c(c(C)n1)S(N1CCN(CC1)C(Cc1ccc(cc1)[Br])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.9264 |
logD: | 1.9264 |
logSw: | -2.2322 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 62.156 |
InChI Key: | UMGUVHSRWPBABN-UHFFFAOYSA-N |