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Chemical structure of (±)-AC 7954 hydrochloride

GC17408

(±)-AC 7954 hydrochloride

Also known as 3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-4H-isochromen-1-one;hydrochloride

urotensin-II (UT) receptor agonist

ChemicalCAS477313-09-0MW366.28FormulaC19H20ClNO2·HCl
CAS number
477313-09-0
Molecular weight
366.28
Formula
C19H20ClNO2·HCl
Solubility
＜27·47mg/ml in DMSO; ＜27·47mg/ml in Water
InChIKey
AJPGLOWFIBOGMH-UHFFFAOYSA-N
Catalogue number
GC17408
Brand
GLPBIO
Computed properties PubChem CID 9907171 · TPSA 29.5 Ų · H-bond donors 1 · H-bond acceptors 3
TPSA
29.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
24

SMILES CN(C)CCC1(CC2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)Cl.Cl

Computed descriptors from PubChem (CID 9907171), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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