Hydronidone

CAT: 0127-BUP13428-05Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP13428-05Size:100 mg

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CAS Number

851518-71-3

Synonyms

F351, F-351, F 351

Purity

=98%

Smiles

Cc1ccc(=O)n(c1)-c1ccc(O)cc1

Chemical Information

Hydronidone

Hydronidone has antifibrotic activity.

CAS Number	851518-71-3
PubChem CID	11217901
IUPAC Name	1-(4-hydroxyphenyl)-5-methylpyridin-2-one
Molecular Formula	C12H11NO2
Molecular Weight	201.22
XLogP	1.5
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	15
Formal Charge	0
Complexity	312

SMILES

CC1=CN(C(=O)C=C1)C2=CC=C(C=C2)O

InChI

InChI=1S/C12H11NO2/c1-9-2-7-12(15)13(8-9)10-3-5-11(14)6-4-10/h2-8,14H,1H3

InChIKey

NETTXQJYJRFTFS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 851518-71-3

CID: 11217901

Formula: C12H11NO2

MW: 201.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	201.22
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	201.078978594
Monoisotopic Mass	201.078978594
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	312
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
M33626-01	Hydronidone
HY-100438R	Hydronidone (Standard)