Cenobamate 10mg

CAT: 0628-A22163-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A22163-10Size:10 mg

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CAS Number

913088-80-9

Chemical Information

Cenobamate

Cenobamate is an organic molecular entity. It has a role as an anticonvulsant.

CAS Number	913088-80-9
PubChem CID	11962412
IUPAC Name	[(1R)-1-(2-chlorophenyl)-2-(tetrazol-2-yl)ethyl] carbamate
Molecular Formula	C10H10ClN5O2
Molecular Weight	267.67
XLogP	1.5
Topological Polar Surface Area	95.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	18
Formal Charge	0
Complexity	293

SMILES

C1=CC=C(C(=C1)[C@H](CN2N=CN=N2)OC(=O)N)Cl

InChI

InChI=1S/C10H10ClN5O2/c11-8-4-2-1-3-7(8)9(18-10(12)17)5-16-14-6-13-15-16/h1-4,6,9H,5H2,(H2,12,17)/t9-/m0/s1

InChIKey

GFHAXPJGXSQLPT-VIFPVBQESA-N

Chemical Structure

2D Structure

CAS: 913088-80-9

CID: 11962412

Formula: C10H10ClN5O2

MW: 267.67

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	267.67
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	267.0523023
Monoisotopic Mass	267.0523023
Topological Polar Surface Area	95.9 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	293
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes