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17058-20-7 | Oxazole, 5-[1,1'-biphenyl]-4-yl-2-(4-methoxyphenyl)-
CAS No: 17058-20-7 Catalog No: AG0078QM MDL No:
Product Description
Catalog Number:
AG0078QM
Chemical Name:
Oxazole, 5-[1,1'-biphenyl]-4-yl-2-(4-methoxyphenyl)-
CAS Number:
17058-20-7
Molecular Formula:
C22H17NO2
Molecular Weight:
327.3759
IUPAC Name:
2-(4-methoxyphenyl)-5-(4-phenylphenyl)-1,3-oxazole
InChI:
InChI=1S/C22H17NO2/c1-24-20-13-11-19(12-14-20)22-23-15-21(25-22)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-15H,1H3
InChI Key:
IKKQTHJCRRDKHZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1ncc(o1)c1ccc(cc1)c1ccccc1
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.383g/mol
Monoisotopic Mass:
327.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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