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10201-21-5 | 4(3H)-Pteridinone, 2-amino-7,8-dihydro-6,7,7-trimethyl-
CAS No: 10201-21-5 Catalog No: AG0006BN MDL No:MFCD13761273
Product Description
Catalog Number:
AG0006BN
Chemical Name:
4(3H)-Pteridinone, 2-amino-7,8-dihydro-6,7,7-trimethyl-
CAS Number:
10201-21-5
Molecular Formula:
C9H13N5O
Molecular Weight:
207.2324
MDL Number:
MFCD13761273
IUPAC Name:
2-amino-6,7,7-trimethyl-3,8-dihydropteridin-4-one
InChI:
InChI=1S/C9H13N5O/c1-4-9(2,3)14-6-5(11-4)7(15)13-8(10)12-6/h1-3H3,(H4,10,12,13,14,15)
InChI Key:
NGOBZCXLWFGBJS-UHFFFAOYSA-N
SMILES:
CC1=Nc2c(NC1(C)C)nc([nH]c2=O)N
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.112g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
207.237g/mol
Monoisotopic Mass:
207.112g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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