3,7-bis(propylsulfanyl)-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Chemical Structure Depiction of
3,7-bis(propylsulfanyl)-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
3,7-bis(propylsulfanyl)-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Compound characteristics
| Compound ID: | 5508-0275 |
| Compound Name: | 3,7-bis(propylsulfanyl)-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine |
| Molecular Weight: | 418.6 |
| Molecular Formula: | C18 H22 N6 S3 |
| Smiles: | CCCSc1nnc2c3c4CCCCc4sc3n3c(nnc3n12)SCCC |
| Stereo: | ACHIRAL |
| logP: | 4.7496 |
| logD: | 4.7492 |
| logSw: | -4.7148 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.387 |
| InChI Key: | ZIUHPNBRSCYNHX-UHFFFAOYSA-N |