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Home Other Building Blocks 1,3,5-Triazine-2,4-diamine, N2-(4-fluorophenyl)-

1,3,5-Triazine-2,4-diamine, N2-(4-fluorophenyl)-

CAS No.:
1549-50-4
Catalog Number:
AG001NH3
Molecular Formula:
C9H8FN5
Molecular Weight:
205.1917
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Product Description
Catalog Number:
AG001NH3
Chemical Name:
1,3,5-Triazine-2,4-diamine, N2-(4-fluorophenyl)-
CAS Number:
1549-50-4
Molecular Formula:
C9H8FN5
Molecular Weight:
205.1917
IUPAC Name:
2-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C9H8FN5/c10-6-1-3-7(4-2-6)14-9-13-5-12-8(11)15-9/h1-5H,(H3,11,12,13,14,15)
InChI Key:
CGCAZIWUCXRTKW-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)Nc1ncnc(n1)N
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.076g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.196g/mol
Monoisotopic Mass:
205.076g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
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
Properties