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Tizanidine-d4 HCl

CAT: 1596-AR-T02398-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-T02398-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1188263-51-5
Synonyms
5-chloro-N- (4,4,5,5-tetradeuterio-1H-imidazol-2-yl) -2,1,3-benzothiadiazol-4-amine hydrochloride; 5-Chloro-N- (4,5-dihydro-1H-imidazol-2-yl-d4) -2,1,3-benzothiadiazol-4-amine Hydrochloride
Molecular Formula
C9H4ClN5SD4. HCl
Molecular Weight
257.74 36.46
API Name
Tizanidine

Chemical Information

5-Chloro-N-[(4,4,5,5-~2~H_4_)-4,5-dihydro-1H-imidazol-2-yl]-2,1,3-benzothiadiazol-4-amine--hydrogen chloride (1/1)
CAS Number1188263-51-5
PubChem CID45359118
IUPAC Name5-chloro-N-(4,4,5,5-tetradeuterio-1H-imidazol-2-yl)-2,1,3-benzothiadiazol-4-amine;hydrochloride
Molecular FormulaC9H9Cl2N5S
Molecular Weight294.20
Topological Polar Surface Area90.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity300
SMILES
[2H]C1(C(N=C(N1)NC2=C(C=CC3=NSN=C32)Cl)([2H])[2H])[2H].Cl
InChI
InChI=1S/C9H8ClN5S.ClH/c10-5-1-2-6-8(15-16-14-6)7(5)13-9-11-3-4-12-9;/h1-2H,3-4H2,(H2,11,12,13);1H/i3D2,4D2;
InChIKey
ZWUKMNZJRDGCTQ-URZLSVTISA-N
Chemical Structure
2D Structure
2D structure of 5-Chloro-N-[(4,4,5,5-~2~H_4_)-4,5-dihydro-1H-imidazol-2-yl]-2,1,3-benzothiadiazol-4-amine--hydrogen chloride (1/1)
CAS: 1188263-51-5
CID: 45359118
Formula: C9H9Cl2N5S
MW: 294.20
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight294.20
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass293.0206789
Monoisotopic Mass293.0206789
Topological Polar Surface Area90.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity300
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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TRC-T449502-1MGTizanidine-d4
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HY-141725S-01N-Acetyl Tizanidine-d4
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