6,7-dimethyl-4-[5-{[(3-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-2-(thiophen-2-yl)quinoline
Chemical Structure Depiction of
6,7-dimethyl-4-[5-{[(3-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-2-(thiophen-2-yl)quinoline
6,7-dimethyl-4-[5-{[(3-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-2-(thiophen-2-yl)quinoline
Compound characteristics
| Compound ID: | V003-4833 |
| Compound Name: | 6,7-dimethyl-4-[5-{[(3-methylphenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-2-(thiophen-2-yl)quinoline |
| Molecular Weight: | 484.69 |
| Molecular Formula: | C28 H28 N4 S2 |
| Salt: | not_available |
| Smiles: | CC(C)n1c(c2cc(c3cccs3)nc3cc(C)c(C)cc23)nnc1SCc1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.4661 |
| logD: | 8.466 |
| logSw: | -6.0878 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.394 |
| InChI Key: | NJDZQZLYMBPJLI-UHFFFAOYSA-N |