4-[({5-[(2-chlorophenoxy)methyl]furan-2-yl}methylidene)amino]-5-ethyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-[({5-[(2-chlorophenoxy)methyl]furan-2-yl}methylidene)amino]-5-ethyl-4H-1,2,4-triazole-3-thiol
4-[({5-[(2-chlorophenoxy)methyl]furan-2-yl}methylidene)amino]-5-ethyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y508-8653 |
| Compound Name: | 4-[({5-[(2-chlorophenoxy)methyl]furan-2-yl}methylidene)amino]-5-ethyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 362.84 |
| Molecular Formula: | C16 H15 Cl N4 O2 S |
| Smiles: | CCc1nnc(n1/N=C/c1ccc(COc2ccccc2[Cl])o1)S |
| Stereo: | ACHIRAL |
| logP: | 3.2884 |
| logD: | 2.7958 |
| logSw: | -3.4032 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.652 |
| InChI Key: | NBBYWKWXYQXBAP-UHFFFAOYSA-N |