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Home > Indoles and Oxindole > 185198-45-2
185198-45-2 | 5(1H)-Indolizinone, 2,3-dihydro-6-phenyl-8-(phenylsulfonyl)-
CAS No: 185198-45-2 Catalog No: AG0074JR MDL No:
Product Description
Catalog Number:
AG0074JR
Chemical Name:
5(1H)-Indolizinone, 2,3-dihydro-6-phenyl-8-(phenylsulfonyl)-
CAS Number:
185198-45-2
Molecular Formula:
C20H17NO3S
Molecular Weight:
351.4189
IUPAC Name:
8-(benzenesulfonyl)-6-phenyl-2,3-dihydro-1H-indolizin-5-one
InChI:
InChI=1S/C20H17NO3S/c22-20-17(15-8-3-1-4-9-15)14-19(18-12-7-13-21(18)20)25(23,24)16-10-5-2-6-11-16/h1-6,8-11,14H,7,12-13H2
InChI Key:
WFJADTRVTUBUFX-UHFFFAOYSA-N
SMILES:
O=c1c(cc(c2n1CCC2)S(=O)(=O)c1ccccc1)c1ccccc1
Properties
Complexity:
702
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.093g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.42g/mol
Monoisotopic Mass:
351.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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