5-(ethylsulfanyl)-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-(ethylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
5-(ethylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
Compound characteristics
| Compound ID: | 5508-0268 |
| Compound Name: | 5-(ethylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol |
| Molecular Weight: | 322.47 |
| Molecular Formula: | C13 H14 N4 S3 |
| Smiles: | CCSC1=Nc2c(c3CCCCc3s2)c2nnc(n12)S |
| Stereo: | ACHIRAL |
| logP: | 3.3439 |
| logD: | 2.5566 |
| logSw: | -3.5843 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.769 |
| InChI Key: | OLEXLFZNBBVQRT-UHFFFAOYSA-N |