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Home > Indoles and Oxindole > 90011-95-3
90011-95-3 | 1H-Isoindole-1,3(2H)-dione, 2-[(2,5-diphenyl-4-oxazolyl)methyl]-
CAS No: 90011-95-3 Catalog No: AG006MCR MDL No:
Product Description
Catalog Number:
AG006MCR
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-[(2,5-diphenyl-4-oxazolyl)methyl]-
CAS Number:
90011-95-3
Molecular Formula:
C24H16N2O3
Molecular Weight:
380.3954
IUPAC Name:
2-[(2,5-diphenyl-1,3-oxazol-4-yl)methyl]isoindole-1,3-dione
InChI:
InChI=1S/C24H16N2O3/c27-23-18-13-7-8-14-19(18)24(28)26(23)15-20-21(16-9-3-1-4-10-16)29-22(25-20)17-11-5-2-6-12-17/h1-14H,15H2
InChI Key:
SKBMTVCFQKOVDR-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2nc(oc2c2ccccc2)c2ccccc2)C(=O)c2c1cccc2
Properties
Complexity:
587
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.116g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
380.403g/mol
Monoisotopic Mass:
380.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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