200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 83325-02-4
83325-02-4 | 6H-Purin-6-one, 1,7-dihydro-2-methyl-7-phenyl-
CAS No: 83325-02-4 Catalog No: AG004X9G MDL No:
Product Description
Catalog Number:
AG004X9G
Chemical Name:
6H-Purin-6-one, 1,7-dihydro-2-methyl-7-phenyl-
CAS Number:
83325-02-4
Molecular Formula:
C12H10N4O
Molecular Weight:
226.2340
IUPAC Name:
2-methyl-7-phenyl-1H-purin-6-one
InChI:
InChI=1S/C12H10N4O/c1-8-14-11-10(12(17)15-8)16(7-13-11)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,15,17)
InChI Key:
AWTIIYWNFHYPFY-UHFFFAOYSA-N
SMILES:
Cc1nc2ncn(c2c(=O)[nH]1)c1ccccc1
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.239g/mol
Monoisotopic Mass:
226.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.