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Home > Aldehydes > 920514-82-5
920514-82-5 | 1H-Indole-3-carboxaldehyde, 6-methoxy-2-(4-methylphenyl)-
CAS No: 920514-82-5 Catalog No: AG006DOJ MDL No:
Product Description
Catalog Number:
AG006DOJ
Chemical Name:
1H-Indole-3-carboxaldehyde, 6-methoxy-2-(4-methylphenyl)-
CAS Number:
920514-82-5
Molecular Formula:
C17H15NO2
Molecular Weight:
265.3065
IUPAC Name:
6-methoxy-2-(4-methylphenyl)-1H-indole-3-carbaldehyde
InChI:
InChI=1S/C17H15NO2/c1-11-3-5-12(6-4-11)17-15(10-19)14-8-7-13(20-2)9-16(14)18-17/h3-10,18H,1-2H3
InChI Key:
GPCUYMJZSMCQSJ-UHFFFAOYSA-N
SMILES:
O=Cc1c([nH]c2c1ccc(c2)OC)c1ccc(cc1)C
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.312g/mol
Monoisotopic Mass:
265.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| CoMFA and docking studies of 2-phenylindole derivatives with anticancer activity. | European journal of medicinal chemistry 20090701 |
| Antimitotic activities of 2-phenylindole-3-carbaldehydes in human breast cancer cells. | Bioorganic & medicinal chemistry 20070801 |
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