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68435-53-0

68435-53-0 | Urea, N-phenyl-N'-2-quinolinyl-

CAS No: 68435-53-0 Catalog No: AG006JU7 MDL No:MFCD02679062

Product Description

Catalog Number:
AG006JU7
Chemical Name:
Urea, N-phenyl-N'-2-quinolinyl-
CAS Number:
68435-53-0
Molecular Formula:
C16H13N3O
Molecular Weight:
263.2939
MDL Number:
MFCD02679062
IUPAC Name:
1-phenyl-3-quinolin-2-ylurea
InChI:
InChI=1S/C16H13N3O/c20-16(17-13-7-2-1-3-8-13)19-15-11-10-12-6-4-5-9-14(12)18-15/h1-11H,(H2,17,18,19,20)
InChI Key:
AQKFDYCJMPYKGG-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc2c(n1)cccc2)Nc1ccccc1

Properties

Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.106g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
263.3g/mol
Monoisotopic Mass:
263.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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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