sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys Trans-1-methyl-4-carboxy-5-(3-pyridyl)-2-pyrrolidinone

Trans-1-methyl-4-carboxy-5-(3-pyridyl)-2-pyrrolidinone

CAS No.:
33224-01-0
Catalog Number:
AG003UVG
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$57
- +
1g
95%
In Stock USA
United States
$115
- +
5g
95%
In Stock USA
United States
$301
- +
Product Description
Catalog Number:
AG003UVG
Chemical Name:
Trans-1-methyl-4-carboxy-5-(3-pyridyl)-2-pyrrolidinone
CAS Number:
33224-01-0
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD00075394
IUPAC Name:
(2S,3S)-1-methyl-5-oxo-2-pyridin-3-ylpyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C11H12N2O3/c1-13-9(14)5-8(11(15)16)10(13)7-3-2-4-12-6-7/h2-4,6,8,10H,5H2,1H3,(H,15,16)/t8-,10+/m0/s1
InChI Key:
DEYLVDCFTICBTB-WCBMZHEXSA-N
SMILES:
OC(=O)[C@H]1CC(=O)N([C@@H]1c1cccnc1)C
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Literature
Title Journal
Exploration of natural compounds as sources of new bifunctional scaffolds targeting cholinesterases and beta amyloid aggregation: the case of chelerythrine. Bioorganic & medicinal chemistry 20121115
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties