5-{[4-(propan-2-yl)phenyl]methylidene}-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[4-(propan-2-yl)phenyl]methylidene}-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[4-(propan-2-yl)phenyl]methylidene}-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-0840 |
| Compound Name: | 5-{[4-(propan-2-yl)phenyl]methylidene}-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C23 H23 N3 O2 S |
| Smiles: | CCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(cc3)C(C)C)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.3888 |
| logD: | 6.3888 |
| logSw: | -5.5826 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.614 |
| InChI Key: | GWMVOEUFJVMIQI-UHFFFAOYSA-N |