Products for Research Use Only
RegisterLogin

Topiroxostat Impurity 16

CAT: 1299-RM-T161842-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1299-RM-T161842-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2044702-36-3
Synonyms
4- (3- (pyridin-4-yl) -1H-1,2,4-triazol-5-yl) picolinic acid
Molecular Formula
C13H9N5O2
Molecular Weight
267.24
Target Alternative Name
Topiroxostat
Product Name Synonym
4- (3- (pyridin-4-yl) -1H-1,2,4-triazol-5-yl) picolinic acid

Chemical Information

Topiroxostat impurity I
CAS Number2044702-36-3
PubChem CID127255967
IUPAC Name4-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxylic acid
Molecular FormulaC13H9N5O2
Molecular Weight267.24
XLogP1
Topological Polar Surface Area105
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity348
SMILES
C1=CN=CC=C1C2=NC(=NN2)C3=CC(=NC=C3)C(=O)O
InChI
InChI=1S/C13H9N5O2/c19-13(20)10-7-9(3-6-15-10)12-16-11(17-18-12)8-1-4-14-5-2-8/h1-7H,(H,19,20)(H,16,17,18)
InChIKey
VJPYIXOHODPLIB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Topiroxostat impurity I
CAS: 2044702-36-3
CID: 127255967
Formula: C13H9N5O2
MW: 267.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight267.24
XLogP31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass267.07562455
Monoisotopic Mass267.07562455
Topological Polar Surface Area105 Ų
Heavy Atom Count20
Formal Charge0
Complexity348
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
RM-T161801-01Topiroxostat Impurity A
RM-T161849-01Topiroxostat Impurity 23
RM-T161915-01Topiroxostat Impurity 88
RM-T161856-01Topiroxostat Impurity 30
RM-T161855-01Topiroxostat Impurity 29
RM-T161924-01Topiroxostat Impurity 97
RM-T161853-01Topiroxostat Impurity 27
RM-T161850-01Topiroxostat Impurity 24
RM-T161896-01Topiroxostat Impurity 70
RM-T161912-01Topiroxostat Impurity 85

Alternative Products

CatalogName
CS-T-94274Topiroxostat Amide impurity
CS-P-02207Topiroxostat Impurity 5
CS-P-01185Topiroxostat Impurity 9
AR-T05575-01Topiroxostat Impurity 41
AR-T05567-01Topiroxostat Impurity 31
AR-T05566-01Topiroxostat Impurity 30
AR-T02653-01Topiroxostat Impurity 2
AR-T02668-01Topiroxostat Impurity 14
AR-T02678-01Topiroxostat Impurity 24
AR-T05570-01Topiroxostat Impurity 34

Popular Products