(4-chlorophenyl)[3-(furan-2-yl)-5-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
(4-chlorophenyl)[3-(furan-2-yl)-5-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]methanone
(4-chlorophenyl)[3-(furan-2-yl)-5-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
| Compound ID: | 6529-0239F |
| Compound Name: | (4-chlorophenyl)[3-(furan-2-yl)-5-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]methanone |
| Molecular Weight: | 319.77 |
| Molecular Formula: | C14 H10 Cl N3 O2 S |
| Smiles: | CSc1nc(c2ccco2)nn1C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4958 |
| logD: | 3.4958 |
| logSw: | -4.035 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.245 |
| InChI Key: | JBCIQOTXWVGRSP-UHFFFAOYSA-N |