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83962-07-6 | 2H-Imidazol-2-one, 4-ethyl-1,3-dihydro-5-[4-(methylsulfonyl)benzoyl]-
CAS No: 83962-07-6 Catalog No: AG0052S3 MDL No:
Product Description
Catalog Number:
AG0052S3
Chemical Name:
2H-Imidazol-2-one, 4-ethyl-1,3-dihydro-5-[4-(methylsulfonyl)benzoyl]-
CAS Number:
83962-07-6
Molecular Formula:
C13H14N2O4S
Molecular Weight:
294.3263
IUPAC Name:
4-ethyl-5-(4-methylsulfonylbenzoyl)-1,3-dihydroimidazol-2-one
InChI:
InChI=1S/C13H14N2O4S/c1-3-10-11(15-13(17)14-10)12(16)8-4-6-9(7-5-8)20(2,18)19/h4-7H,3H2,1-2H3,(H2,14,15,17)
InChI Key:
VFQKVKNICIADBO-UHFFFAOYSA-N
SMILES:
CCc1[nH]c(=O)[nH]c1C(=O)c1ccc(cc1)S(=O)(=O)C
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.067g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.325g/mol
Monoisotopic Mass:
294.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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