5-[(4-methylphenyl)methylidene]-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(4-methylphenyl)methylidene]-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(4-methylphenyl)methylidene]-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 4476-4247 |
| Compound Name: | 5-[(4-methylphenyl)methylidene]-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 319.38 |
| Molecular Formula: | C18 H13 N3 O S |
| Smiles: | Cc1ccc(\C=C2/C(n3c(nc(c4ccccc4)n3)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4096 |
| logD: | 4.4096 |
| logSw: | -4.3926 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.196 |
| InChI Key: | NKLWZZDFSBBTGS-UHFFFAOYSA-N |