200,000+ products from a single source!
sales@angenechem.com
89445-79-4 | 2,4-Pyrimidinediamine, 5-(3-quinolinylmethyl)-
CAS No: 89445-79-4 Catalog No: AG0044FI MDL No:
Product Description
Catalog Number:
AG0044FI
Chemical Name:
2,4-Pyrimidinediamine, 5-(3-quinolinylmethyl)-
CAS Number:
89445-79-4
Molecular Formula:
C14H13N5
Molecular Weight:
251.2865
IUPAC Name:
5-(quinolin-3-ylmethyl)pyrimidine-2,4-diamine
InChI:
InChI=1S/C14H13N5/c15-13-11(8-18-14(16)19-13)6-9-5-10-3-1-2-4-12(10)17-7-9/h1-5,7-8H,6H2,(H4,15,16,18,19)
InChI Key:
SDZJHKSMEJMFMK-UHFFFAOYSA-N
SMILES:
Nc1ncc(c(n1)N)Cc1cnc2c(c1)cccc2
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.117g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.293g/mol
Monoisotopic Mass:
251.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
90.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.