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2-Chloro-7,8-dimethoxy-N,N-dimethyl-10H-phenothiazine-10-propanamine

HCID 87327
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Basic information

CAS
17831-98-0
Standard SMILES
COc1cc2c(cc1OC)N(CCCN(C)C)c1cc(Cl)ccc1S2
InChIKey
BQDFHACIOUBBDF-UHFFFAOYSA-N
Molecular formula
C19H23ClN2O2S
Average molar mass
378.9 g/mol
Monoisotopic mass
378.1168768

Overview

3-(8-chloro-2,3-dimethoxy-10-phenothiazinyl)-N,N-dimethyl-1-propanamine is a member of phenothiazines.

Names & identifiers

Preferred name
2-Chloro-7,8-dimethoxy-N,N-dimethyl-10H-phenothiazine-10-propanamine
IUPAC
3-(8-chloro-2,3-dimethoxyphenothiazin-10-yl)-N,N-dimethylpropan-1-amine
English name
2-Chloro-10-[3-(dimethylamino)propyl]-7,8-dimethoxy-10H-phenothiazine
Molecular formula
C19H23ClN2O2S
Molecular weight
378.92

Names & synonyms

17831-98-0Phenothiazine, 2-chloro-7,8-dimethoxy-10-(3-(dimethylamino)propyl)-DTXSID40170458RefChem:1062801DTXCID10929492-Chloro-7,8-dimethoxy-N,N-dimethyl-10H-phenothiazine-10-propanamine10H-Phenothiazine-10-propanamine, 2-chloro-7,8-dimethoxy-N,N-dimethyl-3-(8-chloro-2,3-dimethoxyphenothiazin-10-yl)-N,N-dimethylpropan-1-amine7,8-DimethoxychlorpromazineBRN 40062172-Chloro-7,8-dimethoxy-10-(3-(dimethylamino)propyl)-3-(8-chloro-2,3-dimethoxy-10h-phenothiazin-10-yl)-n,n-dimethylpropan-1-amine
Show more names
DMOCP2-Chloro-10-[3-(dimethylamino)propyl]-7,8-dimethoxy-10H-phenothiazine2-Chloro-7,8-dimethoxy-N,N-dimethyl-10H-phenothiazine-10-propan-1-amine
CHEBI:125511BRD-K23986500-001-01-1Q272161323-(8-chloro-2,3-dimethoxy-10-phenothiazinyl)-N,N-dimethyl-1-propanamine

Properties

Computed structural propertiesFilling in

XLogP
5.1
Topological polar surface area
50.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
428

Chemistry & industry

Upstream & downstream products

Upstream raw materials

10H-Phenothiazin-3-ol, 8-chloro-2-methoxy-2,5-Cyclohexadiene-1,4-dione, 2-chloro-5-methoxy-

Additional notes

DefinitionChEBI: 3-(8-chloro-2,3-dimethoxy-10-phenothiazinyl)-N,N-dimethyl-1-propanamine is a member of phenothiazines.

Related reactions

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Compound notes

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Database identifiers

CAS
17831-98-0
PubChem CID
87327
DTXSID
DTXSID40170458
ChEBI
CHEBI:125511
Nikkaji
J14.756G