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Chemical structure of Pactimibe

GC61631

Pactimibe

Also known as 2-[7-(2,2-dimethylpropanoylamino)-4,6-dimethyl-1-octyl-2,3-dihydroindol-5-yl]acetic acid

Pactimibe (CS-505 free base) is a dual ACAT1/2 inhibitor with IC50s of 4·9 μM and 3·0 μM, respectively

ChemicalCAS189198-30-9MW416.6FormulaC25H40N2O3
CAS number
189198-30-9
Molecular weight
416.6
Formula
C25H40N2O3
Solubility
DMSO： 200 mg/mL (480·08 mM)
InChIKey
TXIIZHHIOHVWJD-UHFFFAOYSA-N
Catalogue number
GC61631
Brand
GLPBIO
Computed properties PubChem CID 3081927 · XLogP 6.3 · TPSA 69.6 Ų · H-bond donors 2
XLogP
6.3
TPSA
69.6 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
30

SMILES CCCCCCCCN1CCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)C

Computed descriptors from PubChem (CID 3081927), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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