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Home Nitros (S)-Ethyl 2-benzamido-3-(4-nitrophenyl)propanoate

(S)-Ethyl 2-benzamido-3-(4-nitrophenyl)propanoate

CAS No.:
58816-69-6
Catalog Number:
AG00ELVN
Molecular Formula:
C18H18N2O5
Molecular Weight:
342.3459
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥99%
1 week
United States
$91
- +
5mg
≥99%
1 week
United States
$161
- +
10mg
99%
1 week
United States
$223
- +
25mg
99%
1 week
United States
$404
- +
50mg
99%
1 week
United States
$682
- +
100mg
99%
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG00ELVN
Chemical Name:
(S)-Ethyl 2-benzamido-3-(4-nitrophenyl)propanoate
CAS Number:
58816-69-6
Molecular Formula:
C18H18N2O5
Molecular Weight:
342.3459
MDL Number:
MFCD19690954
IUPAC Name:
ethyl (2S)-2-benzamido-3-(4-nitrophenyl)propanoate
InChI:
InChI=1S/C18H18N2O5/c1-2-25-18(22)16(19-17(21)14-6-4-3-5-7-14)12-13-8-10-15(11-9-13)20(23)24/h3-11,16H,2,12H2,1H3,(H,19,21)/t16-/m0/s1
InChI Key:
BEZXGSZPWXRHIN-INIZCTEOSA-N
SMILES:
CCOC(=O)[C@H](Cc1ccc(cc1)[N+](=O)[O-])NC(=O)c1ccccc1
Properties
Complexity:
463  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
342.122g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
342.351g/mol
Monoisotopic Mass:
342.122g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
Selective suppression of Th2-mediated airway eosinophil infiltration by low-molecular weight CCR3 antagonists. International immunology 20070801
Discovery of potent and selective phenylalanine derived CCR3 antagonists. Part 1. Bioorganic & medicinal chemistry letters 20010604
Properties