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84197-57-9 | 2-Azetidinone, 4-benzoyl-1,3,4-triphenyl-
CAS No: 84197-57-9 Catalog No: AG004OZ2 MDL No:
Product Description
Catalog Number:
AG004OZ2
Chemical Name:
2-Azetidinone, 4-benzoyl-1,3,4-triphenyl-
CAS Number:
84197-57-9
Molecular Formula:
C28H21NO2
Molecular Weight:
403.4718
IUPAC Name:
4-benzoyl-1,3,4-triphenylazetidin-2-one
InChI:
InChI=1S/C28H21NO2/c30-26(22-15-7-2-8-16-22)28(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)27(31)29(28)24-19-11-4-12-20-24/h1-20,25H
InChI Key:
XXHMJEMRSIJYSN-UHFFFAOYSA-N
SMILES:
O=C1C(c2ccccc2)C(N1c1ccccc1)(c1ccccc1)C(=O)c1ccccc1
Properties
Complexity:
635
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.157g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
403.481g/mol
Monoisotopic Mass:
403.157g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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