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Hydroxyethylpromethazine

HCID 16406
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Basic information

CAS
7647-63-4
Standard SMILES
CC(CN1c2ccccc2Sc2ccccc21)[N+](C)(C)CCO
InChIKey
PDSVTRQOBUIQBQ-UHFFFAOYSA-N
Molecular formula
C19H25N2OS+
Average molar mass
329.5 g/mol
Monoisotopic mass
329.1687596

Overview

Hydroxyethylpromethazine is a member of phenothiazines.

Names & identifiers

Preferred name
Hydroxyethylpromethazine
IUPAC
2-hydroxyethyl-dimethyl-(1-phenothiazin-10-ylpropan-2-yl)azanium
English name
Aprobit
Molecular formula
C19H25N2OS+
Molecular weight
329.48

Names & synonyms

Promethazine hydroxyethylN-HydroxyethylpromethazinehydroxyethylpromethazineUNII-571559SLAJ(2-hydroxyethyl)dimethyl[1-(10H-phenothiazin-10-yl)propan-2-yl]azaniumAMMONIUM, (2-HYDROXYETHYL)DIMETHYL(1-METHYL-2-PHENOTHIAZIN-10-YLETHYL)-(2-hydroxyethyl)dimethyl(1-(10H-phenothiazin-10-yl)propan-2-yl)azaniumRefChem:1471817647-63-42-hydroxyethyl-dimethyl-(1-phenothiazin-10-ylpropan-2-yl)azanium571559SLAJPromethazine Impurity 67
Show more names
10H-Phenothiazine-10-ethanaminium, N-(2-hydroxyethyl)-N,N,α-trimethyl-
SCHEMBL790774CHEMBL3707371DTXSID30871861CHEBI:135995DB13840Q667687210H-Phenothiazine-10-ethanaminium, N-(2-hydroxyethyl)-N,N,alpha-trimethyl-10H-PHENOTHIAZINE-10-ETHANAMINIUM, N-(2-HYDROXYETHYL)-N,N,.ALPHA.-TRIMETHYL-

Database identifiers

CAS
7647-63-4
PubChem CID
16406
DTXSID
DTXSID30871861
ChEMBL
CHEMBL3707371
ChEBI
CHEBI:135995
UNII
571559SLAJ
Nikkaji
J294.565G

Properties

Computed structural propertiesFilling in

XLogP
4.1
Topological polar surface area
48.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
23
Formal charge
1
Complexity
368

Physicochemical properties

FDA UNII
571559 SLAJ · 571559SLAJ

Chemistry & industry

Pharmacology

ATC Code · 2 items

R - Respiratory system

QR - Respiratory system

Metabolite PathwaysHydroxyethylpromethazine H1-Antihistamine Action

Additional notes

DefinitionChEBI: Hydroxyethylpromethazine is a member of phenothiazines.

Related reactions

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Compound notes

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