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5'-Hydroxyphenyl Carvedilol

CAT: 1596-AR-C01535-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-C01535-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
142227-51-8
Synonyms
3- (2- ((3- ((9H-carbazol-4-yl) oxy) -2-hydroxypropyl) amino) ethoxy) -4-methoxyphenol; 3-[2-[[3- (9H-Carbazol-4-yloxy) -2-hydroxypropyl]amino]ethoxy]-4-methoxyphenol;5-Hydroxycarvedilol; BM 140830
Molecular Formula
C24H26N2O5
Molecular Weight
422.48
API Name
Carvedilol

Chemical Information

5'-Hydroxyphenyl Carvedilol

5'-Hydroxycarvedilol is a member of carbazoles.

CAS Number142227-51-8
PubChem CID4181439
IUPAC Name3-[2-[[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]amino]ethoxy]-4-methoxyphenol
Molecular FormulaC24H26N2O5
Molecular Weight422.5
XLogP3.8
Topological Polar Surface Area96
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count31
Formal Charge0
Complexity538
SMILES
COC1=C(C=C(C=C1)O)OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O
InChI
InChI=1S/C24H26N2O5/c1-29-21-10-9-16(27)13-23(21)30-12-11-25-14-17(28)15-31-22-8-4-7-20-24(22)18-5-2-3-6-19(18)26-20/h2-10,13,17,25-28H,11-12,14-15H2,1H3
InChIKey
PVUVZUBTCLBJMT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5'-Hydroxyphenyl Carvedilol
CAS: 142227-51-8
CID: 4181439
Formula: C24H26N2O5
MW: 422.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.5
XLogP33.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass422.18417193
Monoisotopic Mass422.18417193
Topological Polar Surface Area96 Ų
Heavy Atom Count31
Formal Charge0
Complexity538
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

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AR-C01534-014'-Hydroxyphenyl Carvedilol
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Alternative Products

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sc-210410D5'-Hydroxyphenyl Carvedilol
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sc-219728(R) - (+) -5'-Hydroxyphenyl Carvedilol
TRC-H949127-10MG(R)-(+)-5’-Hydroxyphenyl Carvedilol
TRC-H949126-10MG5'-Hydroxyphenyl Carvedilol-d5
MBS6115729-015'-Hydroxyphenyl-carvedilol (M4)
H9110-19H5’-Hydroxyphenyl-carvedilol (M4)
HY-12767-01Carvedilol metabolite 4-Hydroxyphenyl Carvedilol
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