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869376-63-6 | CB-25
CAS No: 869376-63-6 Catalog No: AG004L99 MDL No:
Product Description
Catalog Number:
AG004L99
Chemical Name:
CB-25
CAS Number:
869376-63-6
Molecular Formula:
C25H41NO3
Molecular Weight:
403.5979
IUPAC Name:
N-cyclopropyl-11-(3-hydroxy-5-pentylphenoxy)undecanamide
InChI:
InChI=1S/C25H41NO3/c1-2-3-10-13-21-18-23(27)20-24(19-21)29-17-12-9-7-5-4-6-8-11-14-25(28)26-22-15-16-22/h18-20,22,27H,2-17H2,1H3,(H,26,28)
InChI Key:
XFHZHCKWTBGPFD-UHFFFAOYSA-N
SMILES:
CCCCCc1cc(OCCCCCCCCCCC(=O)NC2CC2)cc(c1)O
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.309g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
403.607g/mol
Monoisotopic Mass:
403.309g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.5
Literature
| Title | Journal |
|---|---|
| New resorcinol-anandamide 'hybrids' as potent cannabinoid receptor ligands endowed with antinociceptive activity in vivo. | Journal of medicinal chemistry 20090423 |
| Design, synthesis, and binding studies of new potent ligands of cannabinoid receptors. | Journal of medicinal chemistry 20051117 |
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