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157904-67-1 | Oxazole, 2,2'-(1-methylethylidene)bis[4,5-dihydro-4,5-diphenyl-, (4R,4'R,5S,5'S)-
CAS No: 157904-67-1 Catalog No: AG001PT3 MDL No:
Product Description
Catalog Number:
AG001PT3
Chemical Name:
Oxazole, 2,2'-(1-methylethylidene)bis[4,5-dihydro-4,5-diphenyl-, (4R,4'R,5S,5'S)-
CAS Number:
157904-67-1
Molecular Formula:
C33H30N2O2
Molecular Weight:
486.6035
IUPAC Name:
2-[2-(4,5-diphenyl-4,5-dihydro-1,3-oxazol-2-yl)propan-2-yl]-4,5-diphenyl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C33H30N2O2/c1-33(2,31-34-27(23-15-7-3-8-16-23)29(36-31)25-19-11-5-12-20-25)32-35-28(24-17-9-4-10-18-24)30(37-32)26-21-13-6-14-22-26/h3-22,27-30H,1-2H3
InChI Key:
ZWWGNCSTEMMQOQ-UHFFFAOYSA-N
SMILES:
CC(C1=N[C@@H]([C@@H](O1)c1ccccc1)c1ccccc1)(C1=N[C@@H]([C@@H](O1)c1ccccc1)c1ccccc1)C
Properties
Complexity:
744
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
486.231g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
486.615g/mol
Monoisotopic Mass:
486.231g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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