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Home > Indoles and Oxindole > 820234-26-2
820234-26-2 | 1H-Indole-5-carbonitrile, 1-[2-[(3-methoxyphenyl)methoxy]benzoyl]-
CAS No: 820234-26-2 Catalog No: AG004Y8F MDL No:
Product Description
Catalog Number:
AG004Y8F
Chemical Name:
1H-Indole-5-carbonitrile, 1-[2-[(3-methoxyphenyl)methoxy]benzoyl]-
CAS Number:
820234-26-2
Molecular Formula:
C24H18N2O3
Molecular Weight:
382.4113
IUPAC Name:
1-[2-[(3-methoxyphenyl)methoxy]benzoyl]indole-5-carbonitrile
InChI:
InChI=1S/C24H18N2O3/c1-28-20-6-4-5-18(14-20)16-29-23-8-3-2-7-21(23)24(27)26-12-11-19-13-17(15-25)9-10-22(19)26/h2-14H,16H2,1H3
InChI Key:
WPUZQNBUVRUELL-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)COc1ccccc1C(=O)n1ccc2c1ccc(c2)C#N
Properties
Complexity:
615
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.132g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.419g/mol
Monoisotopic Mass:
382.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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