2-ethoxy-4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
2-ethoxy-4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
2-ethoxy-4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
Compound characteristics
Compound ID: | 5629-0454 |
Compound Name: | 2-ethoxy-4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate |
Molecular Weight: | 331.35 |
Molecular Formula: | C15 H13 N3 O4 S |
Smiles: | [H]C(=C1/C(n2c(nc([H])n2)S1)=O)\c1ccc(c(c1)OCC)OC(C)=O |
Stereo: | ACHIRAL |
logP: | 1.5644 |
logD: | 1.5644 |
logSw: | -2.2842 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 66.456 |
InChI Key: | SSRARELSOQHWQU-UHFFFAOYSA-N |