2-(2-ethoxyphenyl)-4-(4-methyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-7-phenoxyquinoline
Chemical Structure Depiction of
2-(2-ethoxyphenyl)-4-(4-methyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-7-phenoxyquinoline
2-(2-ethoxyphenyl)-4-(4-methyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-7-phenoxyquinoline
Compound characteristics
| Compound ID: | V011-1298 |
| Compound Name: | 2-(2-ethoxyphenyl)-4-(4-methyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-7-phenoxyquinoline |
| Molecular Weight: | 558.7 |
| Molecular Formula: | C34 H30 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1ccccc1c1cc(c2ccc(cc2n1)Oc1ccccc1)c1nnc(n1C)SCc1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.6613 |
| logD: | 8.6605 |
| logSw: | -5.9496 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.068 |
| InChI Key: | MQQAQUPTOXUPKC-UHFFFAOYSA-N |