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Chemical structure of DIM-C-pPhCO2Me

GC34557

DIM-C-pPhCO2Me

Also known as methyl 4-[bis(1H-indol-3-yl)methyl]benzoate

DIM-C-pPhCO2Me is a nuclear receptor 4A1 (NR4A1) antagonist· Antineoplastic activity

ChemicalCAS151358-48-4MW380.44FormulaC25H20N2O2
CAS number
151358-48-4
Molecular weight
380.44
Formula
C25H20N2O2
Solubility
DMSO ： ≥ 125 mg/mL (328·57 mM)
InChIKey
BBAOKSZCULLDIW-UHFFFAOYSA-N
Catalogue number
GC34557
Brand
GLPBIO
Computed properties PubChem CID 15637614 · XLogP 5.4 · TPSA 57.9 Ų · H-bond donors 2
XLogP
5.4
TPSA
57.9 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
29

SMILES COC(=O)C1=CC=C(C=C1)C(C2=CNC3=CC=CC=C32)C4=CNC5=CC=CC=C54

Computed descriptors from PubChem (CID 15637614), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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