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Chemical structure of Fedovapagon

GC36037

Fedovapagon

Also known as (2S)-2-N,2-N-dimethyl-1-N-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methyl]pyrrolidine-1,2-dicarboxamide

Fedovapagon (VA106483) is a selective and orally active vasopressin V2 receptor (V2R) agonist with an EC50 of 24 nM

ChemicalCAS347887-36-9MW462.58FormulaC27H34N4O3
CAS number
347887-36-9
Molecular weight
462.58
Formula
C27H34N4O3
Solubility
DMSO： ≥ 125 mg/mL (270·22 mM)
InChIKey
RUOLFWZIFNQQGH-DEOSSOPVSA-N
Catalogue number
GC36037
Brand
GLPBIO
Computed properties PubChem CID 10298385 · XLogP 3.2 · TPSA 73 Ų · H-bond donors 1
XLogP
3.2
TPSA
73 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
34

SMILES CC1=C(C=CC(=C1)C(=O)N2CCCCC3=CC=CC=C32)CNC(=O)N4CCC[C@H]4C(=O)N(C)C

Computed descriptors from PubChem (CID 10298385), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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