2,2,4,7-tetramethyl-6-(2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1,2,3,4-tetrahydroquinoline
Chemical Structure Depiction of
2,2,4,7-tetramethyl-6-(2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1,2,3,4-tetrahydroquinoline
2,2,4,7-tetramethyl-6-(2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1,2,3,4-tetrahydroquinoline
Compound characteristics
| Compound ID: | Y021-1344 |
| Compound Name: | 2,2,4,7-tetramethyl-6-(2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1,2,3,4-tetrahydroquinoline |
| Molecular Weight: | 443.61 |
| Molecular Formula: | C26 H29 N5 S |
| Smiles: | CC1CC(C)(C)Nc2cc(C)c(cc12)c1ccnc2nc(nn12)SCc1ccc(C)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4331 |
| logD: | 5.1574 |
| logSw: | -5.5913 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.862 |
| InChI Key: | VTEBPYXRWSJXPZ-SFHVURJKSA-N |