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29509-91-9

29509-91-9 | Pyrimidine, 4-chloro-2,6-diphenyl-

CAS No: 29509-91-9 Catalog No: AG002YLQ MDL No:MFCD00234890

Product Description

Catalog Number:
AG002YLQ
Chemical Name:
Pyrimidine, 4-chloro-2,6-diphenyl-
CAS Number:
29509-91-9
Molecular Formula:
C16H11ClN2
Molecular Weight:
266.7249
MDL Number:
MFCD00234890
IUPAC Name:
4-chloro-2,6-diphenylpyrimidine
InChI:
InChI=1S/C16H11ClN2/c17-15-11-14(12-7-3-1-4-8-12)18-16(19-15)13-9-5-2-6-10-13/h1-11H
InChI Key:
MJDDVTZXYXHTRY-UHFFFAOYSA-N
SMILES:
Clc1cc(nc(n1)c1ccccc1)c1ccccc1

Properties

Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.061g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.728g/mol
Monoisotopic Mass:
266.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

Literature

Title Journal
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

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