Darifenacin 10mg

CAT: 0628-A11987-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A11987-10Size:10 mg

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CAS Number

133099-04-4

Chemical Information

Darifenacin

Darifenacin is 2-[(3S)-1-Ethylpyrrolidin-3-yl]-2,2-diphenylacetamide in which one of the hydrogens at the 2-position of the ethyl group is substituted by a 2,3-dihydro-1-benzofuran-5-yl group. It is a selective antagonist for the M3 muscarinic acetylcholine receptor, which is primarily responsible for bladder muscle contractions, and is used as the hydrobromide salt in the management of urinary incontinence. It has a role as a muscarinic antagonist and an antispasmodic drug. It is a monocarboxylic acid amide, a member of pyrrolidines and a member of 1-benzofurans.

CAS Number	133099-04-4
PubChem CID	444031
IUPAC Name	2-[(3S)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
Molecular Formula	C28H30N2O2
Molecular Weight	426.5
XLogP	4.6
Topological Polar Surface Area	55.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Heavy Atom Count	32
Formal Charge	0
Complexity	607

SMILES

C1CN(C[C@@H]1C(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N)CCC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C28H30N2O2/c29-27(31)28(23-7-3-1-4-8-23,24-9-5-2-6-10-24)25-14-17-30(20-25)16-13-21-11-12-26-22(19-21)15-18-32-26/h1-12,19,25H,13-18,20H2,(H2,29,31)/t25-/m1/s1

InChIKey

HXGBXQDTNZMWGS-RUZDIDTESA-N

Chemical Structure

2D Structure

CAS: 133099-04-4

CID: 444031

Formula: C28H30N2O2

MW: 426.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	426.5
XLogP3	4.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Exact Mass	426.230728204
Monoisotopic Mass	426.230728204
Topological Polar Surface Area	55.6 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	607
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
HY-A0033-01	Darifenacin
MBS5753802	(+/-)-Darifenacin
GTR19204972-01	(±) -Darifenacin
M33098-01	±-Darifenacin

Darifenacin 10mg

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