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GNE-317

CAS No.:
1394076-92-6
Catalog Number:
AG009CI2
Molecular Formula:
C19H22N6O3S
Molecular Weight:
414.4814
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$189
- +
10mg
99%
1 week
United States
$265
- +
50mg
99%
1 week
United States
$682
- +
100mg
99%
1 week
United States
$918
- +
Product Description
Catalog Number:
AG009CI2
Chemical Name:
GNE-317
CAS Number:
1394076-92-6
Molecular Formula:
C19H22N6O3S
Molecular Weight:
414.4814
MDL Number:
MFCD28900677
IUPAC Name:
5-[6-(3-methoxyoxetan-3-yl)-7-methyl-4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl]pyrimidin-2-amine
InChI:
InChI=1S/C19H22N6O3S/c1-11-13-14(29-15(11)19(26-2)9-28-10-19)17(25-3-5-27-6-4-25)24-16(23-13)12-7-21-18(20)22-8-12/h7-8H,3-6,9-10H2,1-2H3,(H2,20,21,22)
InChI Key:
XOZLHJMDLKDZAL-UHFFFAOYSA-N
SMILES:
COC1(COC1)c1sc2c(c1C)nc(nc2N1CCOCC1)c1cnc(nc1)N
Properties
Complexity:
570  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
414.147g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
414.484g/mol
Monoisotopic Mass:
414.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties