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Chemical structure of Vatinoxan hydrochloride (MK-467 hydrochloride)

GC30938

Vatinoxan hydrochloride (MK-467 hydrochloride)

Also known as N-[2-[(2R,12bS)-2'-oxospiro[1,3,4,6,7,12b-hexahydro-[1]benzofuro[2,3-a]quinolizine-2,5'-imidazolidine]-1'-yl]ethyl]methanesulfonamide;hydrochloride

Vatinoxan hydrochloride (MK-467 hydrochloride) (MK-467 hydrochloride;L-659066 hydrochloride) is a peripheral α2 adrenergic receptor antagonist

ChemicalCAS130466-38-5MW454.97FormulaC20H27ClN4O4S
CAS number
130466-38-5
Molecular weight
454.97
Formula
C20H27ClN4O4S
Solubility
Water : ≥ 133 mg/mL (292·33 mM)
InChIKey
UTMOWVIYZQWJHT-VASSOYJASA-N
Catalogue number
GC30938
Brand
GLPBIO
Computed properties PubChem CID 182976 · TPSA 103 Ų · H-bond donors 3 · H-bond acceptors 6
TPSA
103 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
30

SMILES CS(=O)(=O)NCCN1C(=O)NC[C@]12CCN3CCC4=C([C@@H]3C2)OC5=CC=CC=C45.Cl

Computed descriptors from PubChem (CID 182976), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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