Riluzolamide

CAT: 1596-AR-R01620-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-R01620-02Size:25 Units

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

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CAS Number

1456696-94-8

Synonyms

1- (6- (trifluoromethoxy) benzo[d]thiazol-2-yl) urea; N-[6- (Trifluoromethoxy) -2-benzothiazolyl]urea

Molecular Formula

C9H6F3N3O2S

Molecular Weight

277.23

API Name

Riluzole

Chemical Information

1-(6-(Trifluoromethoxy)benzo[d]thiazol-2-yl)urea

CAS Number	1456696-94-8
PubChem CID	121230751
IUPAC Name	[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]urea
Molecular Formula	C9H6F3N3O2S
Molecular Weight	277.23
XLogP	2.5
Topological Polar Surface Area	105
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Heavy Atom Count	18
Formal Charge	0
Complexity	329

SMILES

C1=CC2=C(C=C1OC(F)(F)F)SC(=N2)NC(=O)N

InChI

InChI=1S/C9H6F3N3O2S/c10-9(11,12)17-4-1-2-5-6(3-4)18-8(14-5)15-7(13)16/h1-3H,(H3,13,14,15,16)

InChIKey

OYIGUOBSFOCBGL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1456696-94-8

CID: 121230751

Formula: C9H6F3N3O2S

MW: 277.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	277.23
XLogP3	2.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	277.01328210
Monoisotopic Mass	277.01328210
Topological Polar Surface Area	105 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	329
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
292238-01	Riluzolamide