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Home Other Building Blocks Skepinone-L

Skepinone-L

CAS No.:
1221485-83-1
Catalog Number:
AG009CER
Molecular Formula:
C24H21F2NO4
Molecular Weight:
425.4246
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$160
- +
5mg
≥98%
1 week
United States
$490
- +
10mg
99%
1 week
United States
$672
- +
50mg
99%
1 week
United States
$1716
- +
Product Description
Catalog Number:
AG009CER
Chemical Name:
Skepinone-L
CAS Number:
1221485-83-1
Molecular Formula:
C24H21F2NO4
Molecular Weight:
425.4246
MDL Number:
MFCD22572738
IUPAC Name:
13-(2,4-difluoroanilino)-5-[(2R)-2,3-dihydroxypropoxy]tricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-one
InChI:
InChI=1S/C24H21F2NO4/c25-16-4-8-23(22(26)10-16)27-17-5-7-20-15(9-17)2-1-14-3-6-19(11-21(14)24(20)30)31-13-18(29)12-28/h3-11,18,27-29H,1-2,12-13H2/t18-/m1/s1
InChI Key:
HXMGCTFLLWPVFM-GOSISDBHSA-N
SMILES:
OC[C@H](COc1ccc2c(c1)C(=O)c1ccc(cc1CC2)Nc1ccc(cc1F)F)O
Properties
Complexity:
608  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
425.144g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
425.432g/mol
Monoisotopic Mass:
425.144g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
C3 exoenzyme impairs cell proliferation and apoptosis by altering the activity of transcription factors. Naunyn-Schmiedeberg's archives of pharmacology 20160101
Design, synthesis, and biological evaluation of novel disubstituted dibenzosuberones as highly potent and selective inhibitors of p38 mitogen activated protein kinase. Journal of medicinal chemistry 20120628
Skepinone-L is a selective p38 mitogen-activated protein kinase inhibitor. Nature chemical biology 20111225
Properties