Pramipexole Formaldehyde Adduct Impurity

CAT: 1596-AR-P29606-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-P29606-01Size:10 Units

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CAS Number

2489686-91-9

Synonyms

1-[[ (6S) -4,5,6,7-Tetrahydro-6- (propylamino) -2-benzothiazolyl]amino]methanol

Molecular Formula

C11H19N3OS

API Name

Pramipexole

Chemical Information

(S)-((6-(Propylamino)-4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)amino)methanol

CAS Number	2489686-91-9
PubChem CID	145710842
IUPAC Name	[[(6S)-6-(propylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]amino]methanol
Molecular Formula	C11H19N3OS
Molecular Weight	241.36
XLogP	1.9
Topological Polar Surface Area	85.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	16
Formal Charge	0
Complexity	217

SMILES

CCCN[C@H]1CCC2=C(C1)SC(=N2)NCO

InChI

InChI=1S/C11H19N3OS/c1-2-5-12-8-3-4-9-10(6-8)16-11(14-9)13-7-15/h8,12,15H,2-7H2,1H3,(H,13,14)/t8-/m0/s1

InChIKey

GTIKONPJEMFVCI-QMMMGPOBSA-N

Chemical Structure

2D Structure

CAS: 2489686-91-9

CID: 145710842

Formula: C11H19N3OS

MW: 241.36

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	241.36
XLogP3	1.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	241.12488341
Monoisotopic Mass	241.12488341
Topological Polar Surface Area	85.4 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	217
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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-P29464-01	Pramipexole Formaldehyde Adduct
AR-L08109-01	Liraglutide Formaldehyde Adduct
AR-P32278-01	Pramipexole Impurity 25
AR-P32279-01	Pramipexole Impurity 31
AR-P32283-01	Pramipexole Impurity 35
AR-P02468-01	Pramipexole Impurity 4
AR-P02479-01	Pramipexole Impurity 15
AR-P02439-01	Pramipexole EP Impurity A
AR-P32284-01	Pramipexole Impurity 36
AR-P32289-01	Pramipexole Impurity 60

Catalog	Name
RM-R142010-01	Ranitidine EP Impurity I; USP Ranitidine Formaldehyde Adduct
462900-01	Pramipexole Mannose Adduct
P700770	Pramipexole Glucose Adduct
sc-235212B	Formaldehyde-sodium bisulfite adduct
TRC-P700810-2.5MG	Pramipexole Ribose Adduct (Mixture of Diastereomers)
RM-P181643-01	Pramipexole Impurity 43 (Pramipexole Dimer)
1245F 05000	Formaldehyde Sodium Bisulphite Adduct 95% Extrapure
RM-P181692-01	Pramipexole Impurity 92
RM-P181637-01	Pramipexole Impurity Z
RM-P181636-01	Pramipexole Impurity V