(S)-α,α-Diphenyl-3-pyrrolidineacetamide L-Tartrate - CAS 134002-26-9

Name: (S)-α,α-Diphenyl-3-pyrrolidineacetamide L-Tartrate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB007852
Product Name:	(S)-α,α-Diphenyl-3-pyrrolidineacetamide L-Tartrate
CAS:	134002-26-9
Synonyms:	3-(S)-(+)-(1-Carbamoyl-1,1-diphenylmethyl)pyrroloidine-L-(+)-tartarate; (3S)-α,α-Diphenyl-3-pyrrolidineacetamide (2R,3R)-2,3-Dihydroxybutanedioate; (S)-3-(1-Carbamoyl-1,1-diphenylmethyl)pyrrolidine L-Tartrate; 3-(S)-(1-Carbamoyl-1,1-diphenylmethyl)pyrrolidine Tartrate

Technical Data

Related CAS:	134002-25-8 (free base)
IUPAC Name:	(2R,3R)-2,3-dihydroxybutanedioic acid;2,2-diphenyl-2-[(3S)-pyrrolidin-3-yl]acetamide
Description:	It is an impurity arising in the synthesis of Darifenacin.
Molecular Weight:	430.45
Molecular Formula:	C22H26N2O7
Canonical SMILES:	C1CNCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.C(C(C(=O)O)O)(C(=O)O)O
InChI:	InChI=1S/C18H20N2O.C4H6O6/c19-17(21)18(16-11-12-20-13-16,14-7-3-1-4-8-14)15-9-5-2-6-10-15;5-1(3(7)8)2(6)4(9)10/h1-10,16,20H,11-13H2,(H2,19,21);1-2,5-6H,(H,7,8)(H,9,10)/t16-;1-,2-/m11/s1
InChI Key:	HRXFENQYWZZQMX-NUFNRNBZSA-N
Melting Point:	185-189°C
Purity:	≥95%
Solubility:	Soluble in DMSO (Slightly), Water (Slightly)
Appearance:	White to Off-white Solid
Storage:	Store at 2-8°C
LogP:	0.97400

Publication Number	Title	Priority Date
CN-112595799-A	LC-MS method for rapidly screening various secondary amines in medicines and intermediates	20201211
US-2021284972-A1	Host cells and methods useful for producing unnatural terpenoids using a novel artificial metalloenzyme	20200313
US-2021292330-A1	Pyrrolidine-fused heterocycles	20200228
WO-2021173923-A1	Pyrrolidine-fused heterocycles	20200228
US-2021269413-A1	Quinazolinone compounds and related compounds	20200221

Complexity:	472
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	3
Defined Bond Stereocenter Count:	0
Exact Mass:	430.17400117
Formal Charge:	0
Heavy Atom Count:	31
Hydrogen Bond Acceptor Count:	8
Hydrogen Bond Donor Count:	6
Isotope Atom Count:	0
Monoisotopic Mass:	430.17400117
Rotatable Bond Count:	7
Topological Polar Surface Area:	170
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0