5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
Chemical Structure Depiction of
5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
Compound characteristics
| Compound ID: | 5662-0019 |
| Compound Name: | 5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol |
| Molecular Weight: | 276.38 |
| Molecular Formula: | C12 H12 N4 S2 |
| Smiles: | CC1=Nc2c(c3CCCCc3s2)c2nnc(n12)S |
| Stereo: | ACHIRAL |
| logP: | 2.3444 |
| logD: | 1.7815 |
| logSw: | -2.1167 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.112 |
| InChI Key: | XVKYVKUHLSBCQL-UHFFFAOYSA-N |