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Home > Indoles and Oxindole > 668419-61-2
668419-61-2 | Benzenesulfonamide, N-[2-(1H-indol-3-yl)-1-methylethyl]-
CAS No: 668419-61-2 Catalog No: AG006QFX MDL No:
Product Description
Catalog Number:
AG006QFX
Chemical Name:
Benzenesulfonamide, N-[2-(1H-indol-3-yl)-1-methylethyl]-
CAS Number:
668419-61-2
Molecular Formula:
C17H18N2O2S
Molecular Weight:
314.4020
IUPAC Name:
N-[1-(1H-indol-3-yl)propan-2-yl]benzenesulfonamide
InChI:
InChI=1S/C17H18N2O2S/c1-13(19-22(20,21)15-7-3-2-4-8-15)11-14-12-18-17-10-6-5-9-16(14)17/h2-10,12-13,18-19H,11H2,1H3
InChI Key:
QSGUHKRLWJUOTK-UHFFFAOYSA-N
SMILES:
CC(NS(=O)(=O)c1ccccc1)Cc1c[nH]c2c1cccc2
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.109g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
314.403g/mol
Monoisotopic Mass:
314.109g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Alpha-methyltryptamine sulfonamide derivatives as novel glucocorticoid receptor ligands. | Bioorganic & medicinal chemistry letters 20070115 |
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