ethyl 1-[3-(benzenesulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(benzenesulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl]piperidine-4-carboxylate
ethyl 1-[3-(benzenesulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl]piperidine-4-carboxylate
Compound characteristics
Compound ID: | E565-0041 |
Compound Name: | ethyl 1-[3-(benzenesulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl]piperidine-4-carboxylate |
Molecular Weight: | 471.56 |
Molecular Formula: | C21 H21 N5 O4 S2 |
Smiles: | CCOC(C1CCN(CC1)c1c2c(ccs2)n2c(c(nn2)S(c2ccccc2)(=O)=O)n1)=O |
Stereo: | ACHIRAL |
logP: | 3.8437 |
logD: | 3.8437 |
logSw: | -3.7673 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 86.9 |
InChI Key: | AGJCOJYCWWGYKI-UHFFFAOYSA-N |