11-{4-oxo-5-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}undecanoic acid
Chemical Structure Depiction of
11-{4-oxo-5-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}undecanoic acid
11-{4-oxo-5-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}undecanoic acid
Compound characteristics
Compound ID: | Y070-0718 |
Compound Name: | 11-{4-oxo-5-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}undecanoic acid |
Molecular Weight: | 486.65 |
Molecular Formula: | C25 H30 N2 O4 S2 |
Smiles: | C=CCN1C(C(=C2/C(N(CCCCCCCCCCC(O)=O)C(=S)S2)=O)/c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 5.2615 |
logD: | 2.4334 |
logSw: | -4.9799 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.795 |
InChI Key: | BLPMQWHTHDLDBR-UHFFFAOYSA-N |