2-(furan-2-yl)-5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(furan-2-yl)-5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(furan-2-yl)-5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
Compound ID: | 6672-0305 |
Compound Name: | 2-(furan-2-yl)-5-{[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
Molecular Weight: | 411.48 |
Molecular Formula: | C21 H21 N3 O4 S |
Smiles: | [H]C(=C1/C(n2c(nc(c3ccco3)n2)S1)=O)\c1ccc(c(c1)OC)OCCC(C)C |
Stereo: | ACHIRAL |
logP: | 4.4044 |
logD: | 4.4044 |
logSw: | -4.2542 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.909 |
InChI Key: | WGRXOVXPTWHNEK-UHFFFAOYSA-N |