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88264-16-8 | Oxazole, 4,5-bis(4-methoxyphenyl)-2-(phenylthio)-
CAS No: 88264-16-8 Catalog No: AG008AVB MDL No:
Product Description
Catalog Number:
AG008AVB
Chemical Name:
Oxazole, 4,5-bis(4-methoxyphenyl)-2-(phenylthio)-
CAS Number:
88264-16-8
Molecular Formula:
C23H19NO3S
Molecular Weight:
389.4669
IUPAC Name:
4,5-bis(4-methoxyphenyl)-2-phenylsulfanyl-1,3-oxazole
InChI:
InChI=1S/C23H19NO3S/c1-25-18-12-8-16(9-13-18)21-22(17-10-14-19(26-2)15-11-17)27-23(24-21)28-20-6-4-3-5-7-20/h3-15H,1-2H3
InChI Key:
PVRUEGAMJMHCFK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1oc(nc1c1ccc(cc1)OC)Sc1ccccc1
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.109g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
389.469g/mol
Monoisotopic Mass:
389.109g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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