2-(4-chlorophenyl)-5-{[4-(methylsulfanyl)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-5-{[4-(methylsulfanyl)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-chlorophenyl)-5-{[4-(methylsulfanyl)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0966 |
| Compound Name: | 2-(4-chlorophenyl)-5-{[4-(methylsulfanyl)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 385.89 |
| Molecular Formula: | C18 H12 Cl N3 O S2 |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)[Cl])n2)S1)=O)\c1ccc(cc1)SC |
| Stereo: | ACHIRAL |
| logP: | 5.4053 |
| logD: | 5.4053 |
| logSw: | -6.2543 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.196 |
| InChI Key: | CFTPYCPJMCVSTG-UHFFFAOYSA-N |