2-methyl-4-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Chemical Structure Depiction of
2-methyl-4-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
2-methyl-4-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | 3993-2050 |
| Compound Name: | 2-methyl-4-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C22 H19 N5 S2 |
| Smiles: | Cc1cc2nnc(n2c2ccccc12)Sc1c2c3CCCCc3sc2nc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9391 |
| logD: | 5.9364 |
| logSw: | -6.0565 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.423 |
| InChI Key: | YSWVOZFAGYICFM-UHFFFAOYSA-N |