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143259-55-6 | Methanone, (1H-indol-4-yl)(3,4,5-trimethoxyphenyl)-
CAS No: 143259-55-6 Catalog No: AG006W9C MDL No:
Product Description
Catalog Number:
AG006W9C
Chemical Name:
Methanone, (1H-indol-4-yl)(3,4,5-trimethoxyphenyl)-
CAS Number:
143259-55-6
Molecular Formula:
C18H17NO4
Molecular Weight:
311.3319
IUPAC Name:
1H-indol-4-yl-(3,4,5-trimethoxyphenyl)methanone
InChI:
InChI=1S/C18H17NO4/c1-21-15-9-11(10-16(22-2)18(15)23-3)17(20)13-5-4-6-14-12(13)7-8-19-14/h4-10,19H,1-3H3
InChI Key:
CLUMHWYRLGICLP-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1OC)OC)C(=O)c1cccc2c1cc[nH]2
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.116g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
311.337g/mol
Monoisotopic Mass:
311.116g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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