Home Halogens 1,3,5-Triazine-2,4-diamine, 6-(chloromethyl)-N2-phenyl-

1,3,5-Triazine-2,4-diamine, 6-(chloromethyl)-N2-phenyl-

CAS No.:
30355-60-3
Catalog Number:
AG002ZUN
Molecular Formula:
C10H10ClN5
Molecular Weight:
235.6729
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Product Description
Catalog Number:
AG002ZUN
Chemical Name:
1,3,5-Triazine-2,4-diamine, 6-(chloromethyl)-N2-phenyl-
CAS Number:
30355-60-3
Molecular Formula:
C10H10ClN5
Molecular Weight:
235.6729
MDL Number:
MFCD00085524
IUPAC Name:
6-(chloromethyl)-2-N-phenyl-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C10H10ClN5/c11-6-8-14-9(12)16-10(15-8)13-7-4-2-1-3-5-7/h1-5H,6H2,(H3,12,13,14,15,16)
InChI Key:
ZEXYPLRLARKYLF-UHFFFAOYSA-N
SMILES:
ClCc1nc(Nc2ccccc2)nc(n1)N
NSC Number:
89736
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.675g/mol
Monoisotopic Mass:
235.062g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
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