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Home > Indoles and Oxindole > 475986-13-1
475986-13-1 | 1-methyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide
CAS No: 475986-13-1 Catalog No: AG019KHV MDL No:MFCD03854806
Product Description
Catalog Number:
AG019KHV
Chemical Name:
1-methyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide
CAS Number:
475986-13-1
Molecular Formula:
C9H10N2O3S
Molecular Weight:
226.2523
MDL Number:
MFCD03854806
IUPAC Name:
1-methyl-2-oxo-3H-indole-5-sulfonamide
InChI:
InChI=1S/C9H10N2O3S/c1-11-8-3-2-7(15(10,13)14)4-6(8)5-9(11)12/h2-4H,5H2,1H3,(H2,10,13,14)
InChI Key:
BYFWIMWXANJNGJ-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(N1C)ccc(c2)S(=O)(=O)N
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.041g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.25g/mol
Monoisotopic Mass:
226.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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