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Home > Indoles and Oxindole > 6913-94-6
6913-94-6 | Indole,1,3-bis[(m-methoxyphenyl)acetyl]- (7CI,8CI)
CAS No: 6913-94-6 Catalog No: AG006CSM MDL No:
Product Description
Catalog Number:
AG006CSM
Chemical Name:
Indole,1,3-bis[(m-methoxyphenyl)acetyl]- (7CI,8CI)
CAS Number:
6913-94-6
Molecular Formula:
C26H23NO4
Molecular Weight:
413.4651
IUPAC Name:
2-(3-methoxyphenyl)-1-[1-[2-(3-methoxyphenyl)acetyl]indol-3-yl]ethanone
InChI:
InChI=1S/C26H23NO4/c1-30-20-9-5-7-18(13-20)15-25(28)23-17-27(24-12-4-3-11-22(23)24)26(29)16-19-8-6-10-21(14-19)31-2/h3-14,17H,15-16H2,1-2H3
InChI Key:
IFDWRMCHRZAJGN-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)CC(=O)c1cn(c2c1cccc2)C(=O)Cc1cccc(c1)OC
NSC Number:
105361
Properties
Complexity:
623
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
413.163g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
413.473g/mol
Monoisotopic Mass:
413.163g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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