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Carvedilol-d5

CAT: 0572-TRC-C184628-1MGSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C184628-1MGSize:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
929106-58-1
Synonyms
1-(9H-Carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-2-propanol-d5; Artist-d5; BM 14190; Cadilan-d5; Carca-d5; Cardivas-d5; Carloc-d5; Carvas-d5; Carvedilol-d5; Carvediol-d5; Coreg-d5; DQ 2466-d5; Dilatrend-d5; Dimitone-d5; Eucardic-d5; Korvasan-d5; Kredex-d5; Querto-d5; SKF 105517-d5; Talliton-d5;
Hazard Statement
Toxic to aquatic life; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
OC(C([2H])([2H])NCCOC1=C(OC)C=CC=C1)([2H])C([2H])([2H])OC2=CC=CC3=C2C4=C(N3)C=CC=C4
Molecular Formula
C24H21D5N2O4
Molecular Weight
411.51
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Carvedilol-d5
CAS Number929106-58-1
PubChem CID45358932
IUPAC Name1-(9H-carbazol-4-yloxy)-1,1,2,3,3-pentadeuterio-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
Molecular FormulaC24H26N2O4
Molecular Weight411.5
XLogP4.2
Topological Polar Surface Area75.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count30
Formal Charge0
Complexity508
SMILES
[2H]C([2H])(C([2H])(C([2H])([2H])OC1=CC=CC2=C1C3=CC=CC=C3N2)O)NCCOC4=CC=CC=C4OC
InChI
InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3/i15D2,16D2,17D
InChIKey
OGHNVEJMJSYVRP-IZIHCQFESA-N
Chemical Structure
2D Structure
2D structure of Carvedilol-d5
CAS: 929106-58-1
CID: 45358932
Formula: C24H26N2O4
MW: 411.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight411.5
XLogP34.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass411.22064104
Monoisotopic Mass411.22064104
Topological Polar Surface Area75.7 Ų
Heavy Atom Count30
Formal Charge0
Complexity508
Isotope Atom Count5
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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