Home Halogens Pyrimidine, 4-chloro-6-methyl-2-phenyl-

Pyrimidine, 4-chloro-6-methyl-2-phenyl-

CAS No.:
29509-92-0
Catalog Number:
AG002YLP
Molecular Formula:
C11H9ClN2
Molecular Weight:
204.6556
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Product Description
Catalog Number:
AG002YLP
Chemical Name:
Pyrimidine, 4-chloro-6-methyl-2-phenyl-
CAS Number:
29509-92-0
Molecular Formula:
C11H9ClN2
Molecular Weight:
204.6556
MDL Number:
MFCD00296931
IUPAC Name:
4-chloro-6-methyl-2-phenylpyrimidine
InChI:
InChI=1S/C11H9ClN2/c1-8-7-10(12)14-11(13-8)9-5-3-2-4-6-9/h2-7H,1H3
InChI Key:
MOLLLUIWZOISLC-UHFFFAOYSA-N
SMILES:
Cc1cc(Cl)nc(n1)c1ccccc1
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.045g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.657g/mol
Monoisotopic Mass:
204.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
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