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5014-83-5 | 4,5-diphenyl-2,3-dihydro-1,3-oxazol-2-one
CAS No: 5014-83-5 Catalog No: AG019IC4 MDL No:MFCD00795999
Product Description
Catalog Number:
AG019IC4
Chemical Name:
4,5-diphenyl-2,3-dihydro-1,3-oxazol-2-one
CAS Number:
5014-83-5
Molecular Formula:
C15H11NO2
Molecular Weight:
237.2533
MDL Number:
MFCD00795999
IUPAC Name:
4,5-diphenyl-3H-1,3-oxazol-2-one
InChI:
InChI=1S/C15H11NO2/c17-15-16-13(11-7-3-1-4-8-11)14(18-15)12-9-5-2-6-10-12/h1-10H,(H,16,17)
InChI Key:
LDPBTGBWTUWCBU-UHFFFAOYSA-N
SMILES:
O=c1oc(c([nH]1)c1ccccc1)c1ccccc1
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.258g/mol
Monoisotopic Mass:
237.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Pharmacophore elucidation and molecular docking studies on 5-phenyl-1-(3-pyridyl)-1h-1,2,4-triazole-3-carboxylic acid derivatives as COX-2 inhibitors. | Scientia pharmaceutica 20100101 |
| Synthesis and biological evaluation of 4,5-diphenyloxazolone derivatives on route towards selective COX-2 inhibitors. | European journal of medicinal chemistry 20090501 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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