2-(11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid
Chemical Structure Depiction of
2-(11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid
2-(11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid
Compound characteristics
| Compound ID: | 8019-5913 |
| Compound Name: | 2-(11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid |
| Molecular Weight: | 364.42 |
| Molecular Formula: | C19 H16 N4 O2 S |
| Smiles: | CC1CCCc2c1c1c3nc(c4ccccc4C(O)=O)nn3C=Nc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.614 |
| logD: | -1.1788 |
| logSw: | -3.8368 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.984 |
| InChI Key: | AUYIPEHCJGVVBT-JTQLQIEISA-N |