5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}-2-(4-propoxyphenyl)[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-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | Y070-1710 |
| Compound Name: | 5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C26 H29 N3 O4 S |
| Smiles: | CCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(c(c3)OC)OCCC(C)C)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.4143 |
| logD: | 6.4143 |
| logSw: | -5.6516 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.749 |
| InChI Key: | KQHRGDSTANSYGT-UHFFFAOYSA-N |