3-[6-oxo-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
3-[6-oxo-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one
3-[6-oxo-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one
Compound characteristics
Compound ID: | 6672-0415 |
Compound Name: | 3-[6-oxo-2-{4-[(prop-2-en-1-yl)oxy]phenyl}[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-(prop-2-en-1-yl)-1,3-dihydro-2H-indol-2-one |
Molecular Weight: | 442.5 |
Molecular Formula: | C24 H18 N4 O3 S |
Smiles: | C=CCN1C(C(=C2/C(n3c(nc(c4ccc(cc4)OCC=C)n3)S2)=O)/c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 4.3687 |
logD: | 4.3687 |
logSw: | -4.5843 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.332 |
InChI Key: | XNBWRQDTJCEIOU-UHFFFAOYSA-N |