Topiroxostat Impurity 44

CAT: 1596-AR-T05578-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T05578-01Size:10 Units

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1824131-48-7

Molecular Formula

C7H6N4O

Molecular Weight

162.15

API Name

Topiroxostat

Chemical Information

6-Cyanonicotinohydrazide

CAS Number	1824131-48-7
PubChem CID	129983755
IUPAC Name	6-cyanopyridine-3-carbohydrazide
Molecular Formula	C7H6N4O
Molecular Weight	162.15
XLogP	-0.6
Topological Polar Surface Area	91.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	219

SMILES

C1=CC(=NC=C1C(=O)NN)C#N

InChI

InChI=1S/C7H6N4O/c8-3-6-2-1-5(4-10-6)7(12)11-9/h1-2,4H,9H2,(H,11,12)

InChIKey

YEESYAYNHPRSML-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1824131-48-7

CID: 129983755

Formula: C7H6N4O

MW: 162.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.15
XLogP3	-0.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	162.05416083
Monoisotopic Mass	162.05416083
Topological Polar Surface Area	91.8 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	219
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-T161801-01	Topiroxostat Impurity A
CS-T-94274	Topiroxostat Amide impurity
CS-P-02207	Topiroxostat Impurity 5
CS-P-01185	Topiroxostat Impurity 9
RM-T161856-01	Topiroxostat Impurity 30
RM-T161855-01	Topiroxostat Impurity 29
RM-T161924-01	Topiroxostat Impurity 97
RM-T161912-01	Topiroxostat Impurity 85
RM-T161834-01	Topiroxostat Impurity 8
RM-T161903-01	Topiroxostat Impurity 76