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88264-20-4

88264-20-4 | Oxazole, 4,5-bis(4-methoxyphenyl)-2-(phenylsulfinyl)-

CAS No: 88264-20-4 Catalog No: AG008AV9 MDL No:

Product Description

Catalog Number:
AG008AV9
Chemical Name:
Oxazole, 4,5-bis(4-methoxyphenyl)-2-(phenylsulfinyl)-
CAS Number:
88264-20-4
Molecular Formula:
C23H19NO4S
Molecular Weight:
405.4663
IUPAC Name:
2-(benzenesulfinyl)-4,5-bis(4-methoxyphenyl)-1,3-oxazole
InChI:
InChI=1S/C23H19NO4S/c1-26-18-12-8-16(9-13-18)21-22(17-10-14-19(27-2)15-11-17)28-23(24-21)29(25)20-6-4-3-5-7-20/h3-15H,1-2H3
InChI Key:
FMORQXIWLKTZBH-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1oc(nc1c1ccc(cc1)OC)S(=O)c1ccccc1

Properties

Complexity:
525  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
405.103g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
405.468g/mol
Monoisotopic Mass:
405.103g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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