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GDC-0068

CAS No.:
1001264-89-6
Catalog Number:
AG00010C
Molecular Formula:
C24H32ClN5O2
Molecular Weight:
457.9962
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$119
- +
5mg
≥98%
1 week
United States
$339
- +
10mg
≥98%
1 week
United States
$557
- +
25mg
≥98%
1 week
United States
$1151
- +
Product Description
Catalog Number:
AG00010C
Chemical Name:
GDC-0068
CAS Number:
1001264-89-6
Molecular Formula:
C24H32ClN5O2
Molecular Weight:
457.9962
MDL Number:
MFCD22124514
IUPAC Name:
(2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-(propan-2-ylamino)propan-1-one
InChI:
InChI=1S/C24H32ClN5O2/c1-15(2)26-13-19(17-4-6-18(25)7-5-17)24(32)30-10-8-29(9-11-30)23-21-16(3)12-20(31)22(21)27-14-28-23/h4-7,14-16,19-20,26,31H,8-13H2,1-3H3/t16-,19-,20-/m1/s1
InChI Key:
GRZXWCHAXNAUHY-NSISKUIASA-N
SMILES:
CC(NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2c1[C@H](C)C[C@H]2O)c1ccc(cc1)Cl)C
UNII:
524Y3IB4HQ
Properties
Complexity:
622  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
457.224g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
458.003g/mol
Monoisotopic Mass:
457.224g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Discovery and preclinical pharmacology of a selective ATP-competitive Akt inhibitor (GDC-0068) for the treatment of human tumors. Journal of medicinal chemistry 20120927
Properties