2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]-1H-isoindole-1,3(2H)-dione
2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 8017-2287 |
Compound Name: | 2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 389.43 |
Molecular Formula: | C20 H15 N5 O2 S |
Smiles: | C1CCc2c(C1)c1c3nc(CN4C(c5ccccc5C4=O)=O)nn3C=Nc1s2 |
Stereo: | ACHIRAL |
logP: | 2.836 |
logD: | 2.8352 |
logSw: | -3.3768 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 64.091 |
InChI Key: | AMQLPLIIDZXVOS-UHFFFAOYSA-N |