5-(benzylsulfanyl)-1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazole
Chemical Structure Depiction of
5-(benzylsulfanyl)-1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazole
5-(benzylsulfanyl)-1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | 6529-0291 |
| Compound Name: | 5-(benzylsulfanyl)-1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazole |
| Molecular Weight: | 431.92 |
| Molecular Formula: | C19 H14 Cl N3 O3 S2 |
| Smiles: | C(c1ccccc1)Sc1nc(c2ccco2)nn1S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.603 |
| logD: | 4.603 |
| logSw: | -4.9442 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.98 |
| InChI Key: | NWPCASJMVWIAOL-UHFFFAOYSA-N |