5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | Y070-2659 |
| Compound Name: | 5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C25 H25 N3 O3 S |
| Smiles: | CC(C)CCOc1ccc(/C=C2/C(n3c(nc(/C=C/c4ccccc4)n3)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.5751 |
| logD: | 5.5751 |
| logSw: | -5.4243 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.321 |
| InChI Key: | QYVQWWLCKQLPCC-UHFFFAOYSA-N |