Methazolamide-d6

CAT: 0926-VWC14230-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0926-VWC14230-02Size:10 mg

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CAS Number

1795142-30-1

Smiles

CC (=O) N=C1N (N=C (S1) S (=O) (=O) N) C

Molecular Formula

C5H8N4O3S2

Molecular Weight

242.3 g/mol

Controlled

Chemical Information

Methazolamide-d6

CAS Number	1795142-30-1
PubChem CID	71749930
IUPAC Name	2,2,2-trideuterio-N-[5-sulfamoyl-3-(trideuteriomethyl)-1,3,4-thiadiazol-2-ylidene]acetamide
Molecular Formula	C5H8N4O3S2
Molecular Weight	242.3
XLogP	0.1
Topological Polar Surface Area	139
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	419

SMILES

[2H]C([2H])([2H])C(=O)N=C1N(N=C(S1)S(=O)(=O)N)C([2H])([2H])[2H]

InChI

InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12)/i1D3,2D3

InChIKey

FLOSMHQXBMRNHR-WFGJKAKNSA-N

Chemical Structure

2D Structure

CAS: 1795142-30-1

CID: 71749930

Formula: C5H8N4O3S2

MW: 242.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	242.3
XLogP3	0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Exact Mass	242.04144295
Monoisotopic Mass	242.04144295
Topological Polar Surface Area	139 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	419
Isotope Atom Count	6
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

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Catalog	Name
464488	Methazolamide-d6
MBS3605013-01	Methazolamide