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Chemical structure of Doxepin (hydrochloride)

GC12892

Doxepin (hydrochloride)

Also known as 3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride

histamine, serotonin, adrenergic, and muscarinic receptors antagonist

ChemicalCAS1229-29-4MW315.8FormulaC19H21NO • HCl
CAS number
1229-29-4
Molecular weight
315.8
Formula
C19H21NO • HCl
Solubility
≥ 15·85mg/mL in DMSO
InChIKey
MHNSPTUQQIYJOT-UHFFFAOYSA-N
Catalogue number
GC12892
Brand
GLPBIO
Computed properties PubChem CID 14675 · TPSA 12.5 Ų · H-bond donors 1 · H-bond acceptors 2
TPSA
12.5 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
22

SMILES CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31.Cl

Computed descriptors from PubChem (CID 14675), 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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