7-[4-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-[4-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
7-[4-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | V003-0679 |
Compound Name: | 7-[4-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine |
Molecular Weight: | 543.04 |
Molecular Formula: | C25 H27 Cl N6 O4 S |
Salt: | not_available |
Smiles: | Cc1cc(c(C)cc1S(N1CCN(CC1)c1c(cnc2ncnn12)c1ccc(c(c1)OC)OC)(=O)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.5313 |
logD: | 4.5238 |
logSw: | -4.7069 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 81.028 |
InChI Key: | LJXCBTRVHBFVGM-UHFFFAOYSA-N |