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Home > Indoles and Oxindole > 880139-07-1
880139-07-1 | N-[2-(1H-indol-3-yl)ethyl]-2,5-dimethoxybenzene-1-sulfonamide
CAS No: 880139-07-1 Catalog No: AG00J022 MDL No:MFCD00245593
Product Description
Catalog Number:
AG00J022
Chemical Name:
N-[2-(1H-indol-3-yl)ethyl]-2,5-dimethoxybenzene-1-sulfonamide
CAS Number:
880139-07-1
Molecular Formula:
C18H20N2O4S
Molecular Weight:
360.4274
MDL Number:
MFCD00245593
IUPAC Name:
N-[2-(1H-indol-3-yl)ethyl]-2,5-dimethoxybenzenesulfonamide
InChI:
InChI=1S/C18H20N2O4S/c1-23-14-7-8-17(24-2)18(11-14)25(21,22)20-10-9-13-12-19-16-6-4-3-5-15(13)16/h3-8,11-12,19-20H,9-10H2,1-2H3
InChI Key:
NNFQQLOQPCIKAD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1S(=O)(=O)NCCc1c[nH]c2c1cccc2)OC
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.114g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
360.428g/mol
Monoisotopic Mass:
360.114g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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