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89039-06-5 | 4(3H)-Pteridinone, 2-(dimethylamino)-7,8-dihydro-3,6,7-trimethyl-
CAS No: 89039-06-5 Catalog No: AG0043C2 MDL No:
Product Description
Catalog Number:
AG0043C2
Chemical Name:
4(3H)-Pteridinone, 2-(dimethylamino)-7,8-dihydro-3,6,7-trimethyl-
CAS Number:
89039-06-5
Molecular Formula:
C11H17N5O
Molecular Weight:
235.2856
IUPAC Name:
2-(dimethylamino)-3,6,7-trimethyl-7,8-dihydropteridin-4-one
InChI:
InChI=1S/C11H17N5O/c1-6-7(2)13-9-8(12-6)10(17)16(5)11(14-9)15(3)4/h7,13H,1-5H3
InChI Key:
WYBNNPVCWXHDKO-UHFFFAOYSA-N
SMILES:
CC1=Nc2c(NC1C)nc(n(c2=O)C)N(C)C
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.143g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.291g/mol
Monoisotopic Mass:
235.143g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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