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Chemical structure of Anticancer agent 9

GC68668

Anticancer agent 9

Also known as methyl 2-[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylmethyl]anilino]acetate

Anticancer agent 9, a derivative of glycine, is an anticancer agent· It can inhibit the tumor cell viability of leukemia and prostate cancer

ChemicalCAS592542-61-5MW465.52FormulaC22H27NO8S
CAS number
592542-61-5
Molecular weight
465.52
Formula
C22H27NO8S
Solubility
DMSO : 50 mg/mL (107·41 mM; Need ultrasonic)
InChIKey
XQGFPRPZKFBYNA-CMDGGOBGSA-N
Catalogue number
GC68668
Brand
GLPBIO
Computed properties PubChem CID 54579435 · XLogP 2.9 · TPSA 118 Ų · H-bond donors 1
XLogP
2.9
TPSA
118 Ų
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
12
Heavy atoms
32

SMILES COC1=C(C=C(C=C1)CS(=O)(=O)/C=C/C2=C(C=C(C=C2OC)OC)OC)NCC(=O)OC

Computed descriptors from PubChem (CID 54579435), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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