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Home > Indoles and Oxindole > 22747-80-4
22747-80-4 | 3H-Indole-2-carboxamide,5-methoxy-N-(4-methoxyphenyl)-3,3-bis(phenylmethyl)-
CAS No: 22747-80-4 Catalog No: AG007NXC MDL No:
Product Description
Catalog Number:
AG007NXC
Chemical Name:
3H-Indole-2-carboxamide,5-methoxy-N-(4-methoxyphenyl)-3,3-bis(phenylmethyl)-
CAS Number:
22747-80-4
Molecular Formula:
C31H28N2O3
Molecular Weight:
476.5656
IUPAC Name:
3,3-dibenzyl-5-methoxy-N-(4-methoxyphenyl)indole-2-carboxamide
InChI:
InChI=1S/C31H28N2O3/c1-35-25-15-13-24(14-16-25)32-30(34)29-31(20-22-9-5-3-6-10-22,21-23-11-7-4-8-12-23)27-19-26(36-2)17-18-28(27)33-29/h3-19H,20-21H2,1-2H3,(H,32,34)
InChI Key:
QSCYSUMLYQJMTQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=O)C1=Nc2c(C1(Cc1ccccc1)Cc1ccccc1)cc(cc2)OC
Properties
Complexity:
727
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
476.21g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
476.576g/mol
Monoisotopic Mass:
476.21g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
59.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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