AG001496

133099-07-7 | 3-Pyrrolidineacetamide, 1-[2-(2,3-dihydro-5-benzofuranyl)ethyl]-α,α-diphenyl-, hydrobromide (1:1), (3S)-

AG001496

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CAS Number	133099-07-7
Catalog Number	AG001496(AGN-PC-03H57Z)
Chemical Name	3-Pyrrolidineacetamide, 1-[2-(2,3-dihydro-5-benzofuranyl)ethyl]-α,α-diphenyl-, hydrobromide (1:1), (3S)-
EC Number	603-705-7
IUPAC Name	2-[(3S)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;hydrobromide
InChI	InChI=1S/C28H30N2O2.BrH/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);1H/t25-;/m1./s1
InChI Key	UQAVIASOPREUIT-VQIWEWKSSA-N
MDL Number	MFCD08141803
Molecular Formula	C28H31BrN2O2
Molecular Weight	507.4619
SMILES	O=C(C(C1=CC=CC=C1)([C@H]2CN(CC2)CCC3=CC4=C(C=C3)OCC4)C5=CC=CC=C5)N.Br
UNII	CR02EYQ8GV
Synonyms	(S)-1-(2-(2,3-dihydro-5-benzofuranyl)ethyl)-alpha,alpha-diphenyl-3-pyrrolidineacetamide, darifenacin, darifenacin hydrobromide, darifenacin hydrochloride, darifenacine, darifenicin, Emselex, Enablex, UK-88525, Darifenacin hydrobromide, darifenacin HBr, 133099-07-7, Darifenacin (hydrobromide), Emselex, UNII-CR02EYQ8GV, UK 88525-04 hydrobromide, CR02EYQ8GV, CHEBI:31455, UK-88525-04, DSSTox_CID_26780, DSSTox_RID_81899, DSSTox_GSID_46780, (S)-2-(1-(2-(2,3-dihydrobenzofuran-5-yl)ethyl)pyrrolidin-3-yl)-2,2-diphenylacetamide hydrobromide, (S)-2-{1-(2-(2,3-Dihydrobenzofuran-5-yl)ethyl)-3-pyrrolidnyl}-2,2-diphenylacetamide hydrobromide, UK-88525, Q-101006, Darilong, 2-[(3S)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide hydrobromide, 3-Pyrrolidineacetamide, 1-(2-(2,3-dihydro-5-benzofuranyl)ethyl)-alpha,alpha-diphenyl-, monohydrobromide, (3S)-, 3-Pyrrolidineacetamide, 1-(2-(2,3-dihydro-5-benzofuranyl)ethyl)-alpha,alpha-diphenyl-, monohydrobromide, (S)-, 3-PYRROLIDINEACETAMIDE, 1-[2-(2,3-DIHYDRO-5-BENZOFURANYL)ETHYL]-ALPHA,ALPHA-DIPHENYL-, HYDROBROMIDE (1:1), (3S)-, CAS-133099-07-7, NCGC00168775-01, Darifenacin hydrobromide [USAN], 2-{(3S)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl}-2,2-diphenylacetamide hydrobromide, Enablex (TN), darifenacin-hydrobromide, PubChem14816, AC1L9FKV, ENABLEX HYDROBROMIDE, CHEMBL1200935, DTXSID9046780, KS-00000KBH, UQAVIASOPREUIT-VQIWEWKSSA-N, HY-A0012, Tox21_112636, Darifenacin hydrobromide (JAN/USAN), MFCD08141803, s3144, AKOS015969311, Tox21_112636_1, AC-1894, AN-6905, API0008085, CCG-220969, CS-0380, MCULE-9754914075, SB17426, NCGC00263922-02, UK-88525-04 (HYDROBROMIDE), AS-35087, BC003938, BC201082, Darifenacin hydrobromide, >=98% (HPLC), AB0073012, LS-186532, SW219426-1, D01699, W-5366, Z1691545283, Darifenacin hydrobromide, United States Pharmacopeia (USP) Reference Standard, (3S)-1-[2-(2,3-Dihydro-5-benzofuranyl)ethyl]-|A-|A-diphenyl-3-pyrrolidineacetamide Hydrobromide, [1-[2-(2,3-DIHYDROBENZOFURAN-5-YL)ETHYL]-3-PYRROLIDNYL]-2,2-DIPHENYLACETAMIDE HYDROBROMIDE, 2-[(3S)-1-[2-(2,3-DIHYDRO-1-BENZOFURAN-5-YL)ETHYL]-3-PYRROLIDINYL]-2,2-DIPHENYLACETAMIDE HYDROBROMIDE, 2-[(3S)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide;hydrobromide, 2-[(3S)-1-[2-(2,3-dihydrobenzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenyl-acetamide hydrobromide, Enablex, Darifenacin Hydrobrimide, C28H30N2O2.BrH, C28-H30-N2-O2.Br-H, CID444030, CS-O-01267, B1600, Darifenacin hydrobromide, 98% - 250MG 250mg, {1-[2-(2,3-Dihydrobenzofuran-5-yl)ethyl]-3-pyrrolidnyl}-2,2-diphenylacetamide hydrobromide,

Complexity	607
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	506.157g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	507.472g/mol
Monoisotopic Mass	506.157g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	55.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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