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Home > Indoles and Oxindole > 89346-32-7
89346-32-7 | 1H-Indole, 4-(2,2-dimethoxyethyl)-1-[(4-methylphenyl)sulfonyl]-
CAS No: 89346-32-7 Catalog No: AG003ZCY MDL No:
Product Description
Catalog Number:
AG003ZCY
Chemical Name:
1H-Indole, 4-(2,2-dimethoxyethyl)-1-[(4-methylphenyl)sulfonyl]-
CAS Number:
89346-32-7
Molecular Formula:
C19H21NO4S
Molecular Weight:
359.4393
IUPAC Name:
4-(2,2-dimethoxyethyl)-1-(4-methylphenyl)sulfonylindole
InChI:
InChI=1S/C19H21NO4S/c1-14-7-9-16(10-8-14)25(21,22)20-12-11-17-15(5-4-6-18(17)20)13-19(23-2)24-3/h4-12,19H,13H2,1-3H3
InChI Key:
XKLAQSYXQFZBCQ-UHFFFAOYSA-N
SMILES:
COC(Cc1cccc2c1ccn2S(=O)(=O)c1ccc(cc1)C)OC
Properties
Complexity:
520
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.119g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
359.44g/mol
Monoisotopic Mass:
359.119g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
65.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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