Moexipril Impurity 1

CAT: 1596-AR-M05006-04Size: 100 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-M05006-04Size:100 Units

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CAS Number

112468-23-2

Molecular Formula

C25H30N2O6

Molecular Weight

452.51

API Name

Moexipril

Chemical Information

Diketopiperazine moexiprilat

CAS Number	112468-23-2
PubChem CID	91810603
IUPAC Name	(2S)-2-[(3S,11aS)-8,9-dimethoxy-3-methyl-1,4-dioxo-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-2-yl]-4-phenylbutanoic acid
Molecular Formula	C25H28N2O6
Molecular Weight	452.5
XLogP	2.9
Topological Polar Surface Area	96.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	7
Heavy Atom Count	33
Formal Charge	0
Complexity	738

SMILES

C[C@H]1C(=O)N2CC3=CC(=C(C=C3C[C@H]2C(=O)N1[C@@H](CCC4=CC=CC=C4)C(=O)O)OC)OC

InChI

InChI=1S/C25H28N2O6/c1-15-23(28)26-14-18-13-22(33-3)21(32-2)12-17(18)11-20(26)24(29)27(15)19(25(30)31)10-9-16-7-5-4-6-8-16/h4-8,12-13,15,19-20H,9-11,14H2,1-3H3,(H,30,31)/t15-,19-,20-/m0/s1

InChIKey

IIPIDAGAGXRRKJ-YSSFQJQWSA-N

Chemical Structure

2D Structure

CAS: 112468-23-2

CID: 91810603

Formula: C25H28N2O6

MW: 452.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	452.5
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	7
Exact Mass	452.19473662
Monoisotopic Mass	452.19473662
Topological Polar Surface Area	96.4 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	738
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
AR-M02152-01	Moexipril HCl
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AR-M05009-01	N-Nitroso Moexipril
AR-M02156-01	Moexipril Acyl Glucuronide
AR-M05007-01	Moexipril-d5 HCl
AR-N01491-01	Nifedipine Impurity 1 (Benidipine Impurity 5)
AR-B01168-01	Benidipine Impurity 5 (Nifedipine Impurity 1)
AR-E10592-01	MTBE Impurity 1 and MTBE Impurity 2
AR-L01467-01	Levocabastine Impurity 1
AR-L06945-01	Levamisole Impurity 1

Alternative Products

Catalog	Name
sc-364540	Moexipril
B2212-50	Moexipril HCl
GEC92949-01	Moexipril-d5
255888-01	Moexipril hydrochloride
sc-484855A	Moexipril Diketopiperazine
HY-117281S1	Moexipril-d3
HY-B0378A-01	Moexipril (hydrochloride)

Moexipril Impurity 1

Chemical Information

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