Praziquantel EP Impurity B

CAT: 1299-RM-P182102-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-P182102-01Size:10 mg

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CAS Number

125273-86-1

Synonyms

2- (cyclohexanecarbonyl) -6,7-dihydro-2H-pyrazino[2,1-a]isoquinolin-4 (3H) -one

Molecular Formula

C19H22N2O2

Molecular Weight

310.39

Target Alternative Name

Praziquantel

Product Name Synonym

2- (cyclohexanecarbonyl) -6,7-dihydro-2H-pyrazino[2,1-a]isoquinolin-4 (3H) -one

Chemical Information

Didehydro praziquantel

CAS Number	125273-86-1
PubChem CID	20345828
IUPAC Name	2-(cyclohexanecarbonyl)-6,7-dihydro-3H-pyrazino[2,1-a]isoquinolin-4-one
Molecular Formula	C19H22N2O2
Molecular Weight	310.4
XLogP	2.8
Topological Polar Surface Area	40.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	23
Formal Charge	0
Complexity	521

SMILES

C1CCC(CC1)C(=O)N2CC(=O)N3CCC4=CC=CC=C4C3=C2

InChI

InChI=1S/C19H22N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,12,15H,1-3,7-8,10-11,13H2

InChIKey

RAZNCTHEBQFYML-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 125273-86-1

CID: 20345828

Formula: C19H22N2O2

MW: 310.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	310.4
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	310.168127949
Monoisotopic Mass	310.168127949
Topological Polar Surface Area	40.6 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	521
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
RM-P182101-01	Praziquantel EP Impurity A
RM-P182103-01	Praziquantel EP Impurity C
RM-P182110-01	Praziquantel Impurity 10
RM-I140401-01	Indometacin EP Impurity A; Bezafibrate EP Impurity B; Acemetacin EP Impurity A; Clopamide EP Impurity B
RM-C061202-01	Cefalexin EP Impurity B; Cefadroxil EP Impurity B; Cefradine EP Impurity A
RM-P182111-01	Praziquantel Impurity 11
RM-O132302-01	Omeprazole EP Impurity B; Esomeprazole EP Impurity B
RM-T081502-01	Theophylline EP Impurity B; Pentoxifylline EP Impurity B
RM-C201212-01	Citalopram EP Impurity B; Escitalopram EP Impurity B
RG-C180501-01	Amylmetacresol EP Impurity B; Metacresol EP Impurity B

Catalog	Name
AR-P02596-01	Praziquantel Impurity G
AR-P32398-01	Praziquantel Impurity 2
AR-P32399-01	Praziquantel Impurity 9
AR-P33631-01	Praziquantel Impurity 8
AR-P02595-01	Praziquantel Impurity E
AR-B06430-01	Praziquantel Impurity 10
AR-P02588-01	Praziquantel EP Impurity A
AR-B06429-01	Praziquantel Impurity 7
AR-P33630-01	Praziquantel Impurity 3
CS-O-63456	Praziquantel Nitroso Impurity 9