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Home > Indoles and Oxindole > 651335-32-9
651335-32-9 | 1H-Indole, 1-(2-piperidinylmethyl)-3-(2-pyridinylsulfonyl)-
CAS No: 651335-32-9 Catalog No: AG006QDV MDL No:
Product Description
Catalog Number:
AG006QDV
Chemical Name:
1H-Indole, 1-(2-piperidinylmethyl)-3-(2-pyridinylsulfonyl)-
CAS Number:
651335-32-9
Molecular Formula:
C19H21N3O2S
Molecular Weight:
355.4539
IUPAC Name:
1-(piperidin-2-ylmethyl)-3-pyridin-2-ylsulfonylindole
InChI:
InChI=1S/C19H21N3O2S/c23-25(24,19-10-4-6-12-21-19)18-14-22(13-15-7-3-5-11-20-15)17-9-2-1-8-16(17)18/h1-2,4,6,8-10,12,14-15,20H,3,5,7,11,13H2
InChI Key:
QTAXFJVIWMCWQF-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1cn(c2c1cccc2)CC1CCCCN1)c1ccccn1
Properties
Complexity:
547
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.135g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
355.456g/mol
Monoisotopic Mass:
355.135g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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