9-tert-butyl-3-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Chemical Structure Depiction of
9-tert-butyl-3-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
9-tert-butyl-3-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Compound characteristics
| Compound ID: | 4159-0104 |
| Compound Name: | 9-tert-butyl-3-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine |
| Molecular Weight: | 346.51 |
| Molecular Formula: | C17 H22 N4 S2 |
| Smiles: | Cc1nnc2c3c4CCC(Cc4sc3N=C(n12)SC)C(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.946 |
| logD: | 3.9456 |
| logSw: | -4.2167 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.491 |
| InChI Key: | RNWLYPCFSGDYNA-SNVBAGLBSA-N |