7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
Compound ID: | G867-0194 |
Compound Name: | 7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
Molecular Weight: | 485.59 |
Molecular Formula: | C21 H23 N7 O3 S2 |
Smiles: | CCc1ccc(s1)S(N1CCN(CC1)c1c2c(ncn1)n(c1cccc(c1)OC)nn2)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7049 |
logD: | 3.7049 |
logSw: | -3.9959 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 90.706 |
InChI Key: | PFLMODBZPMFLDO-UHFFFAOYSA-N |