N-(2-Chloro-6-formylpyridin-3-yl)pivalamide - CAS 1142191-76-1

Name: N-(2-Chloro-6-formylpyridin-3-yl)pivalamide
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB003336
Product Name:	N-(2-Chloro-6-formylpyridin-3-yl)pivalamide
CAS:	1142191-76-1
Synonyms:	N-(2-chloro-6-formylpyridin-3-yl)-2,2-dimethylpropanamide

Technical Data

IUPAC Name:	N-(2-chloro-6-formylpyridin-3-yl)-2,2-dimethylpropanamide
Description:	N-(2-Chloro-6-formylpyridin-3-yl)pivalamide (CAS# 1142191-76-1) is used in the preparation of benzothiazole analogs as positron-emission tomography (PET) agents for diagnosis of Alzheimer's disease.
Molecular Weight:	240.69
Molecular Formula:	C11H13ClN2O2
Canonical SMILES:	CC(C)(C)C(=O)NC1=C(N=C(C=C1)C=O)Cl
InChI:	InChI=1S/C11H13ClN2O2/c1-11(2,3)10(16)14-8-5-4-7(6-15)13-9(8)12/h4-6H,1-3H3,(H,14,16)
InChI Key:	LZRCTDNVNSXRKD-UHFFFAOYSA-N
Purity:	95 %
MDL:	MFCD11857708
LogP:	2.60510

Publication Number	Title	Priority Date
US-2014348748-A1	Beta-amyloid imaging agents, methods of manufacture, and methods of use thereof	20110916
WO-2013040183-A1	Beta-amyloid imaging agents, methods of manufacture, and methods of use thereof	20110916
EP-2558577-A1	Bi-functional complexes and methods for making and using such complexes	20100416
US-2013281324-A1	Bi-functinal complexes and methods for making and using such complexes	20100416
WO-2011127933-A1	Bi-functional complexes and methods for making and using such complexes	20100416

Complexity:	276
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	240.0665554
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	240.0665554
Rotatable Bond Count:	3
Topological Polar Surface Area:	59.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2