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75360-85-9 | Cgp-28237
CAS No: 75360-85-9 Catalog No: AG008QB2 MDL No:
Product Description
Catalog Number:
AG008QB2
Chemical Name:
Cgp-28237
CAS Number:
75360-85-9
Molecular Formula:
C16H15NO4S
Molecular Weight:
317.3596
IUPAC Name:
N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)methanesulfonamide
InChI:
InChI=1S/C16H15NO4S/c1-22(19,20)17-14-9-11-7-8-15(18)13(11)10-16(14)21-12-5-3-2-4-6-12/h2-6,9-10,17H,7-8H2,1H3
InChI Key:
BVWQEBWCUCGHHZ-UHFFFAOYSA-N
SMILES:
O=C1CCc2c1cc(Oc1ccccc1)c(c2)NS(=O)(=O)C
Properties
Complexity:
507
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.072g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.359g/mol
Monoisotopic Mass:
317.072g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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