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Hydroxy Tolbutamide-d9

CAT: 0024-sc-280803Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-280803Size:1 mg
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CAS Number
1185112-19-9

Chemical Information

Hydroxy Tolbutamide-d9
CAS Number1185112-19-9
PubChem CID45039534
IUPAC Name1-[4-(hydroxymethyl)phenyl]sulfonyl-3-(1,1,2,2,3,3,4,4,4-nonadeuteriobutyl)urea
Molecular FormulaC12H18N2O4S
Molecular Weight295.40
XLogP1.1
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count19
Formal Charge0
Complexity370
SMILES
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])NC(=O)NS(=O)(=O)C1=CC=C(C=C1)CO
InChI
InChI=1S/C12H18N2O4S/c1-2-3-8-13-12(16)14-19(17,18)11-6-4-10(9-15)5-7-11/h4-7,15H,2-3,8-9H2,1H3,(H2,13,14,16)/i1D3,2D2,3D2,8D2
InChIKey
SJRHYONYKZIRPM-WRMMWXQOSA-N
Chemical Structure
2D Structure
2D structure of Hydroxy Tolbutamide-d9
CAS: 1185112-19-9
CID: 45039534
Formula: C12H18N2O4S
MW: 295.40
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight295.40
XLogP31.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass295.15521895
Monoisotopic Mass295.15521895
Topological Polar Surface Area104 Ų
Heavy Atom Count19
Formal Charge0
Complexity370
Isotope Atom Count9
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
sc-396112ATolbutamide-d9
sc-396112Tolbutamide-d9
sc-218585Hydroxy Tolbutamide
sc-218585CHydroxy Tolbutamide
sc-218585AHydroxy Tolbutamide
sc-218585BHydroxy Tolbutamide
sc-218585DHydroxy Tolbutamide
sc-2167944-Carboxy Tolbutamide-d9
sc-2167954-Carboxy Tolbutamide-d9 Ethyl Ester
sc-2167964-Carboxy Tolbutamide-d9 Methyl Ester

Alternative Products

CatalogName
TRC-H969852-1MGHydroxy Tolbutamide-d9
TRC-H969853-250MGHydroxy Tolbutamide-d9 Sodium Salt
FH24142-01Hydroxy tolbutamide
TRC-H942432-10MG2-Hydroxy Fluorene-d9
TRC-H940062-10MG4-Hydroxy Phenylbutazone-d9
CS-BU-0012015-Hydroxy Lubiprostone-d9
UWC75240-014-Hydroxy trimethoprim-d9
CS-O-53373Hydroxy methyl Ivacaftor d9
HY-122277S1'-Hydroxy bufuralol-d9
AR-P01352-014-Hydroxy Penbutolol-d9

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