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Gdc-0084

CAS No.:
1382979-44-3
Catalog Number:
AG0018GR
Molecular Formula:
C18H22N8O2
Molecular Weight:
382.4197
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
99%
1 week
United States
$126
- +
5mg
99%
1 week
United States
$175
- +
10mg
99%
1 week
United States
$210
- +
50mg
99%
1 week
United States
$571
- +
100mg
99%
1 week
United States
$1001
- +
Product Description
Catalog Number:
AG0018GR
Chemical Name:
Gdc-0084
CAS Number:
1382979-44-3
Molecular Formula:
C18H22N8O2
Molecular Weight:
382.4197
MDL Number:
MFCD30187522
IUPAC Name:
5-(6,6-dimethyl-4-morpholin-4-yl-8,9-dihydropurino[8,9-c][1,4]oxazin-2-yl)pyrimidin-2-amine
InChI:
InChI=1S/C18H22N8O2/c1-18(2)16-22-12-14(25-3-6-27-7-4-25)23-13(11-9-20-17(19)21-10-11)24-15(12)26(16)5-8-28-18/h9-10H,3-8H2,1-2H3,(H2,19,20,21)
InChI Key:
LGWACEZVCMBSKW-UHFFFAOYSA-N
SMILES:
Nc1ncc(cn1)c1nc(N2CCOCC2)c2c(n1)n1CCOC(c1n2)(C)C
UNII:
P5DKZ70636
Properties
Complexity:
552  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.187g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
382.428g/mol
Monoisotopic Mass:
382.187g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Literature
Title Journal
Oxidative biotransformation of 2-acetylaminofluorene in fetal and placental tissues of humans and monkeys. Correlations with aryl hydrocarbon hydroxylase activities. Drug metabolism and disposition: the biological fate of chemicals 19750101
Properties