4-[5-(benzylsulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Chemical Structure Depiction of
4-[5-(benzylsulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
4-[5-(benzylsulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Compound characteristics
| Compound ID: | V012-0281 |
| Compound Name: | 4-[5-(benzylsulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline |
| Molecular Weight: | 434.56 |
| Molecular Formula: | C27 H22 N4 S |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5782 |
| logD: | 6.5773 |
| logSw: | -6.7156 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.278 |
| InChI Key: | BFLDHPKVGCJSBF-UHFFFAOYSA-N |