4-(3-chlorophenyl)-3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(3-chlorophenyl)-3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole
4-(3-chlorophenyl)-3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V001-1099 |
| Compound Name: | 4-(3-chlorophenyl)-3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 351.8 |
| Molecular Formula: | C16 H12 Cl F2 N3 S |
| Salt: | not_available |
| Smiles: | Cc1nnc(n1c1cccc(c1)[Cl])SCc1cc(cc(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 4.2572 |
| logD: | 4.2572 |
| logSw: | -4.4773 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.7611 |
| InChI Key: | APAZEOAOIJFATG-UHFFFAOYSA-N |