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98623-50-8 | 2-(1H-Indol-5-yl);-N-methylethanesulfonamide
CAS No: 98623-50-8 Catalog No: AG005U1Q MDL No:MFCD08458722
Product Description
Catalog Number:
AG005U1Q
Chemical Name:
2-(1H-Indol-5-yl);-N-methylethanesulfonamide
CAS Number:
98623-50-8
Molecular Formula:
C11H14N2O2S
Molecular Weight:
238.3061
MDL Number:
MFCD08458722
IUPAC Name:
2-(1H-indol-5-yl)-N-methylethanesulfonamide
InChI:
InChI=1S/C11H14N2O2S/c1-12-16(14,15)7-5-9-2-3-11-10(8-9)4-6-13-11/h2-4,6,8,12-13H,5,7H2,1H3
InChI Key:
PPXMUBLAPJLGNE-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)CCc1ccc2c(c1)cc[nH]2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.078g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.305g/mol
Monoisotopic Mass:
238.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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