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88543-65-1 | 4(3H)-Pteridinone, 2-amino-5,6,7,8-tetrahydro-3,6,7-trimethyl-
CAS No: 88543-65-1 Catalog No: AG004DPB MDL No:
Product Description
Catalog Number:
AG004DPB
Chemical Name:
4(3H)-Pteridinone, 2-amino-5,6,7,8-tetrahydro-3,6,7-trimethyl-
CAS Number:
88543-65-1
Molecular Formula:
C9H15N5O
Molecular Weight:
209.2483
IUPAC Name:
2-amino-3,6,7-trimethyl-5,6,7,8-tetrahydropteridin-4-one
InChI:
InChI=1S/C9H15N5O/c1-4-5(2)12-7-6(11-4)8(15)14(3)9(10)13-7/h4-5,11-12H,1-3H3,(H2,10,13)
InChI Key:
MDBUEUVMUKLLIX-UHFFFAOYSA-N
SMILES:
CC1Nc2c(NC1C)nc(n(c2=O)C)N
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.128g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
209.253g/mol
Monoisotopic Mass:
209.128g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
82.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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