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2-Chloro-3-methoxy-N,N-dimethyl-10H-phenothiazine-10-propanamine

HCID 87313
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Basic information

CAS
17800-20-3
Standard SMILES
COc1cc2c(cc1Cl)N(CCCN(C)C)c1ccccc1S2
InChIKey
CEHKBRONOPQZSA-UHFFFAOYSA-N
Molecular formula
C18H21ClN2OS
Average molar mass
348.9 g/mol
Monoisotopic mass
348.1063122

Names & identifiers

Preferred name
2-Chloro-3-methoxy-N,N-dimethyl-10H-phenothiazine-10-propanamine
IUPAC
3-(2-chloro-3-methoxyphenothiazin-10-yl)-N,N-dimethylpropan-1-amine
English name
2-Chloro-10-[3-(dimethylamino)propyl]-3-methoxy-10H-phenothiazine
Molecular weight
0

Names & synonyms

17800-20-3Phenothiazine, 2-chloro-10-(3-(dimethylamino)propyl)-3-methoxy-DTXSID80170412RefChem:1062758DTXCID50929032-Chloro-3-methoxy-N,N-dimethyl-10H-phenothiazine-10-propanamine3-MethoxychlorpromazineBRN 15972143-(2-chloro-3-methoxyphenothiazin-10-yl)-N,N-dimethylpropan-1-amine2-Chloro-3-methoxy-10-(3-(dimethylamino)propyl)phenothiazine2-Chloro-10-[3-(dimethylamino)propyl]-3-methoxy-10H-phenothiazine3-(2-chloro-3-methoxy-10h-phenothiazin-10-yl)-n,n-dimethylpropan-1-amine
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2-Chloro-3-methoxy-N,N-dimethyl-10H-phenothiazine-10-propan-1-amine

Database identifiers

CAS
17800-20-3
PubChem CID
87313
DTXSID
DTXSID80170412
Nikkaji
J15.441E

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
41 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
23
Formal charge
0
Complexity
384

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