3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V007-4341 |
| Compound Name: | 3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 325.41 |
| Molecular Formula: | C18 H16 F N3 S |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2ccccc2F)nnc1SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1378 |
| logD: | 4.1378 |
| logSw: | -4.4862 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.2191 |
| InChI Key: | UNCBSBKJKAAOBJ-UHFFFAOYSA-N |