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Home > Indoles and Oxindole > 824960-57-8
824960-57-8 | Methanone, (7-ethyl-1-naphthalenyl)(1-propyl-1H-indol-3-yl)-
CAS No: 824960-57-8 Catalog No: AG004ZGF MDL No:
Product Description
Catalog Number:
AG004ZGF
Chemical Name:
Methanone, (7-ethyl-1-naphthalenyl)(1-propyl-1H-indol-3-yl)-
CAS Number:
824960-57-8
Molecular Formula:
C24H23NO
Molecular Weight:
341.4455
IUPAC Name:
(7-ethylnaphthalen-1-yl)-(1-propylindol-3-yl)methanone
InChI:
InChI=1S/C24H23NO/c1-3-14-25-16-22(19-9-5-6-11-23(19)25)24(26)20-10-7-8-18-13-12-17(4-2)15-21(18)20/h5-13,15-16H,3-4,14H2,1-2H3
InChI Key:
KRWLDGSOXOZAQJ-UHFFFAOYSA-N
SMILES:
CCCn1cc(c2c1cccc2)C(=O)c1cccc2c1cc(CC)cc2
UNII:
8T0GX6UZQ3
Properties
Complexity:
489
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.178g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.454g/mol
Monoisotopic Mass:
341.178g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
Literature
| Title | Journal |
|---|---|
| Development of CoMFA and CoMSIA models of affinity and selectivity for indole ligands of cannabinoid CB1 and CB2 receptors. | European journal of medicinal chemistry 20090601 |
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