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Home > Indoles and Oxindole > 1461713-86-9
1461713-86-9 | 1-(piperidine-3-sulfonyl)-2,3-dihydro-1H-indole hydrochloride
CAS No: 1461713-86-9 Catalog No: AG01A737 MDL No:MFCD25970519
Product Description
Catalog Number:
AG01A737
Chemical Name:
1-(piperidine-3-sulfonyl)-2,3-dihydro-1H-indole hydrochloride
CAS Number:
1461713-86-9
Molecular Formula:
C13H19ClN2O2S
Molecular Weight:
302.8202
MDL Number:
MFCD25970519
IUPAC Name:
1-piperidin-3-ylsulfonyl-2,3-dihydroindole;hydrochloride
InChI:
InChI=1S/C13H18N2O2S.ClH/c16-18(17,12-5-3-8-14-10-12)15-9-7-11-4-1-2-6-13(11)15;/h1-2,4,6,12,14H,3,5,7-10H2;1H
InChI Key:
SIYLOVWFHOPFGL-UHFFFAOYSA-N
SMILES:
O=S(=O)(N1CCc2c1cccc2)C1CCCNC1.Cl
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.086g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
302.817g/mol
Monoisotopic Mass:
302.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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