200,000+ products from a single source!
sales@angenechem.com
101622-53-1 | 9H-Purin-6-amine, 2-chloro-9-methyl-N-(phenylmethyl)-
CAS No: 101622-53-1 Catalog No: AG0004Z6 MDL No:
Product Description
Catalog Number:
AG0004Z6
Chemical Name:
9H-Purin-6-amine, 2-chloro-9-methyl-N-(phenylmethyl)-
CAS Number:
101622-53-1
Molecular Formula:
C13H12ClN5
Molecular Weight:
273.7209
IUPAC Name:
N-benzyl-2-chloro-9-methylpurin-6-amine
InChI:
InChI=1S/C13H12ClN5/c1-19-8-16-10-11(17-13(14)18-12(10)19)15-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,17,18)
InChI Key:
QNKNBVBQFILDGJ-UHFFFAOYSA-N
SMILES:
Clc1nc(NCc2ccccc2)c2c(n1)n(C)cn2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.724g/mol
Monoisotopic Mass:
273.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.