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Home > Indoles and Oxindole > 121679-20-7
121679-20-7 | 1H-Indole-5-ethanesulfonamide, N-methyl-3-(1,2,3,6-tetrahydro-1-methyl-4-pyridinyl)-
CAS No: 121679-20-7 Catalog No: AG0015K0 MDL No:
Product Description
Catalog Number:
AG0015K0
Chemical Name:
1H-Indole-5-ethanesulfonamide, N-methyl-3-(1,2,3,6-tetrahydro-1-methyl-4-pyridinyl)-
CAS Number:
121679-20-7
Molecular Formula:
C17H23N3O2S
Molecular Weight:
333.4484
IUPAC Name:
N-methyl-2-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]ethanesulfonamide
InChI:
InChI=1S/C17H23N3O2S/c1-18-23(21,22)10-7-13-3-4-17-15(11-13)16(12-19-17)14-5-8-20(2)9-6-14/h3-5,11-12,18-19H,6-10H2,1-2H3
InChI Key:
UJPMSESNMYEKDD-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)CCc1ccc2c(c1)c(c[nH]2)C1=CCN(CC1)C
UNII:
YCR9MR124U
Properties
Complexity:
541
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.151g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
333.45g/mol
Monoisotopic Mass:
333.151g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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