Vonoprazan Impurity 123

CAT: 1299-RM-V141723-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-V141723-01Size:10 mg

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CAS Number

24367-50-8

Synonyms

1,2-di (pyridin-3-yl) disulfane

Molecular Formula

C10H8N2S2

Molecular Weight

220.31

Target Alternative Name

Vonoprazan

Product Name Synonym

1,2-di (pyridin-3-yl) disulfane

Chemical Information

3,3'-Dipyridyl disulfide

RN given is for di-HCl; RN for parent cpd not in Chemline 7/29/83; structure

CAS Number	24367-50-8
PubChem CID	188949
IUPAC Name	3-(pyridin-3-yldisulfanyl)pyridine
Molecular Formula	C10H8N2S2
Molecular Weight	220.3
XLogP	1.9
Topological Polar Surface Area	76.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	14
Formal Charge	0
Complexity	148

SMILES

C1=CC(=CN=C1)SSC2=CN=CC=C2

InChI

InChI=1S/C10H8N2S2/c1-3-9(7-11-5-1)13-14-10-4-2-6-12-8-10/h1-8H

InChIKey

YURPISYZTZHYBW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 24367-50-8

CID: 188949

Formula: C10H8N2S2

MW: 220.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	220.3
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	220.01289061
Monoisotopic Mass	220.01289061
Topological Polar Surface Area	76.4 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	148
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