3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-1187 |
| Compound Name: | 3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 397.88 |
| Molecular Formula: | C20 H16 Cl N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccccc1n1c(c2ccco2)nnc1SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7747 |
| logD: | 4.7744 |
| logSw: | -4.8582 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.62 |
| InChI Key: | XXFLGJYAXBVCID-UHFFFAOYSA-N |