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RAF709

CAS No.:
1628838-42-5
Catalog Number:
AG00ASTP
Molecular Formula:
C28H29F3N4O4
Molecular Weight:
542.5495
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$105
- +
5mg
99%
1 week
United States
$182
- +
10mg
99%
1 week
United States
$265
- +
25mg
99%
1 week
United States
$473
- +
50mg
99%
1 week
United States
$737
- +
100mg
99%
1 week
United States
$1154
- +
Product Description
Catalog Number:
AG00ASTP
Chemical Name:
RAF709
CAS Number:
1628838-42-5
Molecular Formula:
C28H29F3N4O4
Molecular Weight:
542.5495
MDL Number:
MFCD30534393
IUPAC Name:
N-[6-methyl-5-[5-morpholin-4-yl-6-(oxan-4-yloxy)pyridin-3-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide
InChI:
InChI=1S/C28H29F3N4O4/c1-18-24(15-22(17-32-18)34-26(36)19-3-2-4-21(13-19)28(29,30)31)20-14-25(35-7-11-38-12-8-35)27(33-16-20)39-23-5-9-37-10-6-23/h2-4,13-17,23H,5-12H2,1H3,(H,34,36)
InChI Key:
FYNMINFUAIDIFL-UHFFFAOYSA-N
SMILES:
Cc1ncc(cc1c1cnc(c(c1)N1CCOCC1)OC1CCOCC1)NC(=O)c1cccc(c1)C(F)(F)F
Properties
Complexity:
793  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
542.214g/mol
Formal Charge:
0
Heavy Atom Count:
39  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
542.559g/mol
Monoisotopic Mass:
542.214g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
Reactions of cytosine and cytidine with O-substituted hydroxylamines. Journal of the Chemical Society. Perkin transactions 1 19750101
Properties