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GSK3326595

CAS No.:
1616392-22-3
Catalog Number:
AG01EN4E
Molecular Formula:
C24H32N6O3
Molecular Weight:
452.5493
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$126
- +
10mg
99%
1 week
United States
$154
- +
50mg
99%
1 week
United States
$404
- +
100mg
99%
1 week
United States
$682
- +
200mg
99%
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG01EN4E
Chemical Name:
GSK3326595
CAS Number:
1616392-22-3
Molecular Formula:
C24H32N6O3
Molecular Weight:
452.5493
MDL Number:
MFCD29991177
IUPAC Name:
6-[(1-acetylpiperidin-4-yl)amino]-N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]pyrimidine-4-carboxamide
InChI:
InChI=1S/C24H32N6O3/c1-17(31)30-10-7-20(8-11-30)28-23-12-22(26-16-27-23)24(33)25-13-21(32)15-29-9-6-18-4-2-3-5-19(18)14-29/h2-5,12,16,20-21,32H,6-11,13-15H2,1H3,(H,25,33)(H,26,27,28)/t21-/m0/s1
InChI Key:
JLCCNYVTIWRPIZ-NRFANRHFSA-N
SMILES:
O[C@H](CN1CCc2c(C1)cccc2)CNC(=O)c1ncnc(c1)NC1CCN(CC1)C(=O)C
Properties
Complexity:
656  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
452.254g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
452.559g/mol
Monoisotopic Mass:
452.254g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties