sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys Ethyl 6-oxo-2-phenyl-1,6-dihydro-5-pyrimidinecarboxylate

Ethyl 6-oxo-2-phenyl-1,6-dihydro-5-pyrimidinecarboxylate

CAS No.:
55613-22-4
Catalog Number:
AG00D875
Molecular Formula:
C13H12N2O3
Molecular Weight:
244.2460
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$72
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00D875
Chemical Name:
Ethyl 6-oxo-2-phenyl-1,6-dihydro-5-pyrimidinecarboxylate
CAS Number:
55613-22-4
Molecular Formula:
C13H12N2O3
Molecular Weight:
244.2460
MDL Number:
MFCD00695462
IUPAC Name:
ethyl 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate
InChI:
InChI=1S/C13H12N2O3/c1-2-18-13(17)10-8-14-11(15-12(10)16)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,14,15,16)
InChI Key:
JSIHCFJCICVJHJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc([nH]c1=O)c1ccccc1
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.085g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.25g/mol
Monoisotopic Mass:
244.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties