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Cdk9-in-1

CAS No.:
1415559-43-1
Catalog Number:
AG009CAD
Molecular Formula:
C26H21N5O4S
Molecular Weight:
499.5410
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
95%
1 week
United States
$193
- +
10mg
95%
1 week
United States
$314
- +
50mg
95%
1 week
United States
$790
- +
100mg
95%
1 week
United States
$1390
- +
Product Description
Catalog Number:
AG009CAD
Chemical Name:
Cdk9-in-1
CAS Number:
1415559-43-1
Molecular Formula:
C26H21N5O4S
Molecular Weight:
499.5410
MDL Number:
MFCD22124471
IUPAC Name:
N-[5-[[6-[3-(1,3-dioxoisoindol-2-yl)phenyl]pyrimidin-4-yl]amino]-2-methylphenyl]methanesulfonamide
InChI:
InChI=1S/C26H21N5O4S/c1-16-10-11-18(13-22(16)30-36(2,34)35)29-24-14-23(27-15-28-24)17-6-5-7-19(12-17)31-25(32)20-8-3-4-9-21(20)26(31)33/h3-15,30H,1-2H3,(H,27,28,29)
InChI Key:
CKUFOBCNTCLXJP-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1NS(=O)(=O)C)Nc1ncnc(c1)c1cccc(c1)N1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
900  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
499.131g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
499.545g/mol
Monoisotopic Mass:
499.131g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties