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Chemical structure of rac-7-methoxy Propranolol

GC40967

rac-7-methoxy Propranolol

Also known as 1-(7-methoxynaphthalen-1-yl)oxy-3-(propan-2-ylamino)propan-2-ol

Propranolol, one of the first β-blockers used in cardiovascular medicine, inhibits β1-, β2-, and β3-adrenergic receptors with log KD values of -8·16, -9·08, and -6·93, respectively

ChemicalCAS76275-53-1MW289.4FormulaC17H23NO3
CAS number
76275-53-1
Molecular weight
289.4
Formula
C17H23NO3
Solubility
DMF: 50 mg/ml,DMF:PBS(pH 7·2)(1:1): 0·5 mg/ml,DMSO: 30 mg/ml,Ethanol: 30 mg/ml
InChIKey
SHLYYDPCAGPWOZ-UHFFFAOYSA-N
Catalogue number
GC40967
Brand
GLPBIO
Computed properties PubChem CID 12672897 · XLogP 3 · TPSA 50.7 Ų · H-bond donors 2
XLogP
3
TPSA
50.7 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
21

SMILES CC(C)NCC(COC1=CC=CC2=C1C=C(C=C2)OC)O

Computed descriptors from PubChem (CID 12672897), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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