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Chemical structure of Promethazine-d4 hydrochloride

GC69738

Promethazine-d4 hydrochloride

Also known as N,N-dimethyl-1-(1,3,7,9-tetradeuteriophenothiazin-10-yl)propan-2-amine;hydrochloride

Promethazine-d4 (hydrochloride) is the deuterated form of Promethazine hydrochloride· Promethazine hydrochloride is a first-generation antihistamine with H1 receptor potent antagonism and mAChR antagonism, as well as some affinity for 5-HT2A, 5-HT2C, D2, and alpha-1 adrenergic receptors

ChemicalCAS1173018-74-0MW324.9FormulaC17H17D4ClN2S
CAS number
1173018-74-0
Molecular weight
324.9
Formula
C17H17D4ClN2S
Solubility
H2O ： 100 mg/mL (307·79 mM; Need ultrasonic); DMSO ： 50 mg/mL (153·89 mM; Need ultrasonic)
InChIKey
XXPDBLUZJRXNNZ-RPMJCVFWSA-N
Catalogue number
GC69738
Brand
GLPBIO
Computed properties PubChem CID 71312314 · TPSA 31.8 Ų · H-bond donors 1 · H-bond acceptors 3
TPSA
31.8 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21

SMILES [2H]C1=CC(=C2C(=C1)SC3=CC(=CC(=C3N2CC(C)N(C)C)[2H])[2H])[2H].Cl

Computed descriptors from PubChem (CID 71312314), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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