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125774-17-6

125774-17-6 | 2,5-Pyrrolidinedione, 1-(phenylmethyl)-3-(phenylsulfonyl)-

CAS No: 125774-17-6 Catalog No: AG000OOW MDL No:

Product Description

Catalog Number:
AG000OOW
Chemical Name:
2,5-Pyrrolidinedione, 1-(phenylmethyl)-3-(phenylsulfonyl)-
CAS Number:
125774-17-6
Molecular Formula:
C17H15NO4S
Molecular Weight:
329.3703
IUPAC Name:
3-(benzenesulfonyl)-1-benzylpyrrolidine-2,5-dione
InChI:
InChI=1S/C17H15NO4S/c19-16-11-15(23(21,22)14-9-5-2-6-10-14)17(20)18(16)12-13-7-3-1-4-8-13/h1-10,15H,11-12H2
InChI Key:
FUXYZMLNRWMPDN-UHFFFAOYSA-N
SMILES:
O=C1CC(C(=O)N1Cc1ccccc1)S(=O)(=O)c1ccccc1

Properties

Complexity:
554  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.072g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.37g/mol
Monoisotopic Mass:
329.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
79.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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