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1016-31-5 | 2,4-Oxazolidinedione, 5-methyl-3-(phenylmethyl)-
CAS No: 1016-31-5 Catalog No: AG0004Y9 MDL No:
Product Description
Catalog Number:
AG0004Y9
Chemical Name:
2,4-Oxazolidinedione, 5-methyl-3-(phenylmethyl)-
CAS Number:
1016-31-5
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
IUPAC Name:
3-benzyl-5-methyl-1,3-oxazolidine-2,4-dione
InChI:
InChI=1S/C11H11NO3/c1-8-10(13)12(11(14)15-8)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChI Key:
XBFXNORSBOKBTO-UHFFFAOYSA-N
SMILES:
CC1OC(=O)N(C1=O)Cc1ccccc1
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| N-Acyl and N-sulfonyloxazolidine-2,4-diones are pseudo-irreversible inhibitors of serine proteases. | Bioorganic & medicinal chemistry letters 20120615 |
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