Apatinib Mesylate Impurity 7

CAT: 1299-RM-A271007-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-A271007-01Size:10 mg

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CAS Number

28489-58-9

Synonyms

N- (pyridin-4-ylmethyl) isonicotinamide

Molecular Formula

C12H11N3O

Molecular Weight

213.24

Target Alternative Name

Apatinib Mesylate

Product Name Synonym

N- (pyridin-4-ylmethyl) isonicotinamide

Chemical Information

4-Pyridinecarboxamide, N-(4-pyridinylmethyl)-

CAS Number	28489-58-9
PubChem CID	811490
IUPAC Name	N-(pyridin-4-ylmethyl)pyridine-4-carboxamide
Molecular Formula	C12H11N3O
Molecular Weight	213.23
XLogP	0.6
Topological Polar Surface Area	54.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	16
Formal Charge	0
Complexity	220

SMILES

C1=CN=CC=C1CNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C12H11N3O/c16-12(11-3-7-14-8-4-11)15-9-10-1-5-13-6-2-10/h1-8H,9H2,(H,15,16)

InChIKey

AQVNQXCOBGHOPL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 28489-58-9

CID: 811490

Formula: C12H11N3O

MW: 213.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	213.23
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	213.090211983
Monoisotopic Mass	213.090211983
Topological Polar Surface Area	54.9 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	220
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-A271002-01	Apatinib Mesylate Impurity 2
RM-A271005-01	Apatinib Mesylate Impurity 5
RM-A271004-01	Apatinib Mesylate Impurity 4
RM-A271006-01	Apatinib Mesylate Impurity 6
RM-A271001-01	Apatinib Mesylate Impurity 1
RM-A271003-01	Apatinib Mesylate Impurity 3
RM-E180207-01	Eribulin Mesylate Impurity 7
RM-P081317-01	Phentolamine Mesylate Impurity 17
RM-E180210-01	Eribulin Mesylate Impurity 10
RM-E180209-01	Eribulin Mesylate Impurity 9

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B1608-5	Apatinib mesylate
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AR-D06674-01	Deferoxamine Mesylate Impurity 5
AR-D06673-01	Deferoxamine Mesylate Impurity 4