Chlorpromazine Impurity 1

CAT: 1596-AR-C07240-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-C07240-01Size:10 Units

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CAS Number

1622313-77-2

Molecular Formula

C18H21ClN2S

Molecular Weight

332.89

API Name

Chlorpromazine

Chemical Information

N-Desmethyl N-Ethyl Chlorpromazine

CAS Number	1622313-77-2
PubChem CID	166177235
IUPAC Name	3-(2-chlorophenothiazin-10-yl)-N-ethyl-N-methylpropan-1-amine
Molecular Formula	C18H21ClN2S
Molecular Weight	332.9
XLogP	5.6
Topological Polar Surface Area	31.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	22
Formal Charge	0
Complexity	354

SMILES

CCN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN2S/c1-3-20(2)11-6-12-21-15-7-4-5-8-17(15)22-18-10-9-14(19)13-16(18)21/h4-5,7-10,13H,3,6,11-12H2,1-2H3

InChIKey

MZEOTQWGSTYINM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1622313-77-2

CID: 166177235

Formula: C18H21ClN2S

MW: 332.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	332.9
XLogP3	5.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	332.1113975
Monoisotopic Mass	332.1113975
Topological Polar Surface Area	31.8 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	354
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-C07247-01	Chlorpromazine Impurity 2
AR-C02515-01	Chlorpromazine EP Impurity A
AR-C07244-01	Chlorpromazine Impurity 3
AR-C02519-01	Chlorpromazine EP Impurity E
AR-C02521-01	Chlorpromazine EP Impurity B DiHCl
AR-C02522-01	Chlorpromazine EP Impurity F HCl
AR-C02523-01	Chlorpromazine EP Impurity D HCl
AR-C05604-01	N-Nitroso Chlorpromazine EP Impurity E
AR-C05603-01	N-Nitroso Chlorpromazine EP Impurity D
AR-C02511-01	Chlorpromazine HCl

Catalog	Name
RM-C081212-01	Chlorpromazine Impurity 12
RM-C081248-01	Chlorpromazine Impurity 48
RM-C081201-01	Chlorpromazine EP Impurity A
RM-C081211-01	Chlorpromazine Impurity 11
RM-C081208-01	Chlorpromazine Impurity 8
RM-C081207-01	Chlorpromazine Impurity 7
RM-C081209-01	Chlorpromazine EP Impurity F
RM-C081246-01	Chlorpromazine Nitroso Impurity 46
RM-C081247-01	Chlorpromazine Nitroso Impurity 47
RM-C081245-01	Chlorpromazine Nitroso Impurity 45