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89792-53-0 | 6(5H)-Pteridinone,4-amino-7-methyl-
CAS No: 89792-53-0 Catalog No: AG003ZDU MDL No:
Product Description
Catalog Number:
AG003ZDU
Chemical Name:
6(5H)-Pteridinone,4-amino-7-methyl-
CAS Number:
89792-53-0
Molecular Formula:
C7H7N5O
Molecular Weight:
177.1634
IUPAC Name:
4-amino-7-methyl-5H-pteridin-6-one
InChI:
InChI=1S/C7H7N5O/c1-3-7(13)12-4-5(8)9-2-10-6(4)11-3/h2H,1H3,(H,12,13)(H2,8,9,10,11)
InChI Key:
CLIDOXHOMUAWKH-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c(N)ncnc2nc1C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.065g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.167g/mol
Monoisotopic Mass:
177.065g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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