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Hydrochlorothiazide-D2

CAT: 1299-RM-H032031-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-H032031-02Size:25 mg
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CAS Number
1219798-89-6
Synonyms
6-chloro-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazine-7-sulfonamide-3,3-d2 1,1-dioxide
Molecular Formula
C7H6D2ClN3O4S2
Molecular Weight
299.74
Target Alternative Name
Hydrochlorothiazide
Product Name Synonym
6-chloro-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazine-7-sulfonamide-3,3-d2 1,1-dioxide

Chemical Information

Hydrochlorothiazide-d2
CAS Number1219798-89-6
PubChem CID76973170
IUPAC Name6-chloro-3,3-dideuterio-1,1-dioxo-2,4-dihydro-1lambda6,2,4-benzothiadiazine-7-sulfonamide
Molecular FormulaC7H8ClN3O4S2
Molecular Weight299.8
XLogP-0.1
Topological Polar Surface Area135
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity494
SMILES
[2H]C1(NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl)[2H]
InChI
InChI=1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)/i3D2
InChIKey
JZUFKLXOESDKRF-SMZGMGDZSA-N
Chemical Structure
2D Structure
2D structure of Hydrochlorothiazide-d2
CAS: 1219798-89-6
CID: 76973170
Formula: C7H8ClN3O4S2
MW: 299.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight299.8
XLogP3-0.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count1
Exact Mass298.9770293
Monoisotopic Mass298.9770293
Topological Polar Surface Area135 Ų
Heavy Atom Count17
Formal Charge0
Complexity494
Isotope Atom Count2
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-H714561-1MGHydrochlorothiazide-d2
AR-H01174-01Hydrochlorothiazide-13C-d2
QXB00603-01Hydrochlorothiazide-13C, d2
TRC-H714562-10MGHydrochlorothiazide-13C,d2
CS-O-06663Hydrochlorothiazide-15N2,13C, d2
CS-EO-02660N-Nitroso Hydrochlorothiazide D2
AR-H01170-01Hydrochlorothiazide-15N2-13C-d2
TRC-H714563-10MGHydrochlorothiazide-13C,15N2,d2
sc-491307Hydrochlorothiazide-13C,15N2, d2
CS-O-492574-Nitroso Hydrochlorothiazide-13C-d2

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