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32585-54-9 | N-[2-(1H-indol-3-yl)ethyl]benzenesulfonamide
CAS No: 32585-54-9 Catalog No: AG019OXL MDL No:MFCD04616178
Product Description
Catalog Number:
AG019OXL
Chemical Name:
N-[2-(1H-indol-3-yl)ethyl]benzenesulfonamide
CAS Number:
32585-54-9
Molecular Formula:
C16H16N2O2S
Molecular Weight:
300.3754
MDL Number:
MFCD04616178
IUPAC Name:
N-[2-(1H-indol-3-yl)ethyl]benzenesulfonamide
InChI:
InChI=1S/C16H16N2O2S/c19-21(20,14-6-2-1-3-7-14)18-11-10-13-12-17-16-9-5-4-8-15(13)16/h1-9,12,17-18H,10-11H2
InChI Key:
CTDQKZGWJQNLIZ-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)NCCc1c[nH]c2c1cccc2
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.093g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
300.376g/mol
Monoisotopic Mass:
300.093g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Interaction of chiral MS-245 analogs at h5-HT6 receptors. | Bioorganic & medicinal chemistry letters 20050801 |
| 1,2,3,4-tetrahydrocarbazoles as 5-HT6 serotonin receptor ligands. | Bioorganic & medicinal chemistry letters 20040419 |
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