Flutimide

CAT: 0926-MGA66634-04Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-MGA66634-04Size:50 mg

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CAS Number

162666-34-4

MDL Number

MFCD00940476

Smiles

CC (C) CC1=NC (=CC (C) C) C (=O) N (C1=O) O

Molecular Formula

C12H18N2O3

Molecular Weight

238.28 g/mol

Controlled

Chemical Information

Flutimide

Flutimide is an organonitrogen compound and an organooxygen compound. It is functionally related to an alpha-amino acid.

CAS Number	162666-34-4
PubChem CID	6443207
IUPAC Name	(5Z)-1-hydroxy-3-(2-methylpropyl)-5-(2-methylpropylidene)pyrazine-2,6-dione
Molecular Formula	C12H18N2O3
Molecular Weight	238.28
XLogP	1.7
Topological Polar Surface Area	70
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	395

SMILES

CC(C)CC1=N/C(=C\C(C)C)/C(=O)N(C1=O)O

InChI

InChI=1S/C12H18N2O3/c1-7(2)5-9-11(15)14(17)12(16)10(13-9)6-8(3)4/h5,7-8,17H,6H2,1-4H3/b9-5-

InChIKey

SIXHCCPAJIVTOY-UITAMQMPSA-N

Chemical Structure

2D Structure

CAS: 162666-34-4

CID: 6443207

Formula: C12H18N2O3

MW: 238.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	238.28
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	238.13174244
Monoisotopic Mass	238.13174244
Topological Polar Surface Area	70 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	395
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
450254-01	Flutimide