Basic information
- CAS
2095-24-1- Standard SMILES
CN(C)CCN1c2ccccc2Sc2ccc(Cl)cc21- InChIKey
ILROKGAXBGPFAI-UHFFFAOYSA-N- Molecular formula
- C16H17ClN2S
- Average molar mass
- 304.8 g/mol
- Monoisotopic mass
- 304.0800974
Overview
2-(2-chloro-10-phenothiazinyl)-N,N-dimethylethanamine is a member of phenothiazines.
Names & identifiers
- Preferred name
- Chlorfenethazine
- IUPAC
- 2-(2-chlorophenothiazin-10-yl)-N,N-dimethylethanamine
- English name
- Chlorphenethazin
- Molecular formula
- C16H17ClN2S
- Molecular weight
- 304.84
Names & synonyms
ChlorphenethazineChlorfenethazine2095-24-1Ethyl chlorpromazineJ205NZ30N22-Chloro-10-(2-(dimethylamino)ethyl)phenothiazinePhenothiazine, 2-chloro-10-(2-(dimethylamino)ethyl)-10H-Phenothiazine-10-ethanamine, 2-chloro-N,N-dimethyl-2-Chloro-10-(beta-dimethylaminoethyl)phenothiazineRefChem:918448Chlorphenethazin2-(2-chlorophenothiazin-10-yl)-N,N-dimethylethanamine
Show more names
CHEMBL27194CHOLRPHENETHAZINEProbes1_000252Probes2_000293UNII-J205NZ30N2SCHEMBL3456873[2-(2-Chloro-phenothiazin-10-yl)-ethyl]-dimethyl-amineDTXSID00943241
Database identifiers
- CAS
2095-24-1- PubChem CID
- 62861
- DTXSID
DTXSID00943241- ChEMBL
CHEMBL27194- ChEBI
CHEBI:125651- UNII
- J205NZ30N2
- Nikkaji
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 31.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Density
- 1.1899 · 1.1899 (rough estimate)
- refractive index
- 1.61 · 1.6100 (estimate)
- Water Solubility
- 4.573 mg/L · 4.573mg/L(temperature not stated)
- FDA UNII
- 205 NZ30N2 · J205NZ30N2
Chemistry & industry
Suppliers2 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
CHEMICAL LAND21[email protected]
Additional notes
DefinitionChEBI: 2-(2-chloro-10-phenothiazinyl)-N,N-dimethylethanamine is a member of phenothiazines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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