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Sb-674042

CAS No.:
483313-22-0
Catalog Number:
AG00DB7D
Molecular Formula:
C24H21FN4O2S
Molecular Weight:
448.5125
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$94
- +
5mg
≥98%
1 week
United States
$189
- +
10mg
≥98%
1 week
United States
$301
- +
25mg
≥98%
1 week
United States
$619
- +
Product Description
Catalog Number:
AG00DB7D
Chemical Name:
Sb-674042
CAS Number:
483313-22-0
Molecular Formula:
C24H21FN4O2S
Molecular Weight:
448.5125
MDL Number:
MFCD18251550
IUPAC Name:
[5-(2-fluorophenyl)-2-methyl-1,3-thiazol-4-yl]-[(2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyrrolidin-1-yl]methanone
InChI:
InChI=1S/C24H21FN4O2S/c1-15-26-21(22(32-15)18-11-5-6-12-19(18)25)24(30)29-13-7-10-17(29)14-20-27-28-23(31-20)16-8-3-2-4-9-16/h2-6,8-9,11-12,17H,7,10,13-14H2,1H3/t17-/m0/s1
InChI Key:
HYBZWVLPALMACV-KRWDZBQOSA-N
SMILES:
Cc1sc(c(n1)C(=O)N1CCCC1Cc1nnc(o1)c1ccccc1)c1ccccc1F
Properties
Complexity:
652  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
448.137g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
448.516g/mol
Monoisotopic Mass:
448.137g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  
Literature
Title Journal
Selective orexin receptor antagonists. Bioorganic & medicinal chemistry letters 20130901
Ligand-induced internalization of the orexin OX(1) and cannabinoid CB(1) receptors assessed via N-terminal SNAP and CLIP-tagging. British journal of pharmacology 20110301
Properties