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849343-13-1 | Oxazole, 2,2'-(1,4-phenylene)bis[4,5-dihydro-5-methyl-4-phenyl-
CAS No: 849343-13-1 Catalog No: AG004RGE MDL No:
Product Description
Catalog Number:
AG004RGE
Chemical Name:
Oxazole, 2,2'-(1,4-phenylene)bis[4,5-dihydro-5-methyl-4-phenyl-
CAS Number:
849343-13-1
Molecular Formula:
C26H24N2O2
Molecular Weight:
396.4810
IUPAC Name:
5-methyl-2-[4-(5-methyl-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl)phenyl]-4-phenyl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C26H24N2O2/c1-17-23(19-9-5-3-6-10-19)27-25(29-17)21-13-15-22(16-14-21)26-28-24(18(2)30-26)20-11-7-4-8-12-20/h3-18,23-24H,1-2H3
InChI Key:
WRNPKVNJXBIFHW-UHFFFAOYSA-N
SMILES:
CC1OC(=NC1c1ccccc1)c1ccc(cc1)C1=NC(C(O1)C)c1ccccc1
Properties
Complexity:
583
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.184g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.49g/mol
Monoisotopic Mass:
396.184g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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