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27644-74-2 | 4(3H)-Pteridinone, 2-amino-6,7-dihydro-6,7-dimethyl-
CAS No: 27644-74-2 Catalog No: AG002UAV MDL No:
Product Description
Catalog Number:
AG002UAV
Chemical Name:
4(3H)-Pteridinone, 2-amino-6,7-dihydro-6,7-dimethyl-
CAS Number:
27644-74-2
Molecular Formula:
C8H11N5O
Molecular Weight:
193.2058
IUPAC Name:
2-amino-6,7-dimethyl-6,7-dihydro-3H-pteridin-4-one
InChI:
InChI=1S/C8H11N5O/c1-3-4(2)11-6-5(10-3)7(14)13-8(9)12-6/h3-4H,1-2H3,(H3,9,11,12,13,14)
InChI Key:
HNCQOYKEJCZSSI-UHFFFAOYSA-N
SMILES:
CC1N=c2nc(N)[nH]c(=O)c2=NC1C
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.096g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.21g/mol
Monoisotopic Mass:
193.096g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
92.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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