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Chemical structure of H2-003

GC74105

H2-003

Also known as methyl 3-benzamido-5-(butan-2-ylamino)-1-(furan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate

H2-003 is a selective human DGAT2 inhibitor that inhibits triglyceride (TG) biosynthesis

ChemicalCAS1060438-30-3MW446.5FormulaC25H26N4O4
CAS number
1060438-30-3
Molecular weight
446.5
Formula
C25H26N4O4
Solubility
DMSO ： 125 mg/mL (279·96 mM; Need ultrasonic)
InChIKey
LDIDJPZRWAUNLN-UHFFFAOYSA-N
Catalogue number
GC74105
Brand
GLPBIO
Computed properties PubChem CID 45159482 · XLogP 4.8 · TPSA 98.4 Ų · H-bond donors 2
XLogP
4.8
TPSA
98.4 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
33

SMILES CCC(C)NC1=CC2=C(N=C1)N(C(=C2NC(=O)C3=CC=CC=C3)C(=O)OC)CC4=CC=CO4

Computed descriptors from PubChem (CID 45159482), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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