2-phenyl-4-[4-(prop-2-en-1-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]quinoline
Chemical Structure Depiction of
2-phenyl-4-[4-(prop-2-en-1-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]quinoline
2-phenyl-4-[4-(prop-2-en-1-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]quinoline
Compound characteristics
| Compound ID: | V011-5636 |
| Compound Name: | 2-phenyl-4-[4-(prop-2-en-1-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]quinoline |
| Molecular Weight: | 502.56 |
| Molecular Formula: | C28 H21 F3 N4 S |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.6126 |
| logD: | 7.6116 |
| logSw: | -6.853 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.278 |
| InChI Key: | AFWXMGFCDKKVIE-UHFFFAOYSA-N |