200,000+ products from a single source!
sales@angenechem.com
113494-43-2 | 2,4-Pyrimidinediamine, 5-(3-azido-4-fluorophenyl)-6-ethyl-
CAS No: 113494-43-2 Catalog No: AG0008RT MDL No:
Product Description
Catalog Number:
AG0008RT
Chemical Name:
2,4-Pyrimidinediamine, 5-(3-azido-4-fluorophenyl)-6-ethyl-
CAS Number:
113494-43-2
Molecular Formula:
C12H12FN7
Molecular Weight:
273.2690
IUPAC Name:
5-(3-azido-4-fluorophenyl)-6-ethylpyrimidine-2,4-diamine
InChI:
InChI=1S/C12H12FN7/c1-2-8-10(11(14)18-12(15)17-8)6-3-4-7(13)9(5-6)19-20-16/h3-5H,2H2,1H3,(H4,14,15,17,18)
InChI Key:
AGQZNHDQKULLBJ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1cc(ccc1F)c1c(N)nc(nc1CC)N
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.114g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
273.275g/mol
Monoisotopic Mass:
273.114g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
92.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.