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88743-94-6 | 1,3,4-Oxadiazolidin-2-one, 5-(2-methylphenyl)-3,4-diphenyl-
CAS No: 88743-94-6 Catalog No: AG004E0Z MDL No:
Product Description
Catalog Number:
AG004E0Z
Chemical Name:
1,3,4-Oxadiazolidin-2-one, 5-(2-methylphenyl)-3,4-diphenyl-
CAS Number:
88743-94-6
Molecular Formula:
C21H18N2O2
Molecular Weight:
330.3798
IUPAC Name:
5-(2-methylphenyl)-3,4-diphenyl-1,3,4-oxadiazolidin-2-one
InChI:
InChI=1S/C21H18N2O2/c1-16-10-8-9-15-19(16)20-22(17-11-4-2-5-12-17)23(21(24)25-20)18-13-6-3-7-14-18/h2-15,20H,1H3
InChI Key:
NSNCHNXDZZRFGA-UHFFFAOYSA-N
SMILES:
O=C1OC(N(N1c1ccccc1)c1ccccc1)c1ccccc1C
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.137g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.387g/mol
Monoisotopic Mass:
330.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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