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88334-69-4 | 5(4H)-Oxazolone, 4-[(9-ethyl-9H-carbazol-3-yl)methylene]-2-phenyl-
CAS No: 88334-69-4 Catalog No: AG0046PV MDL No:
Product Description
Catalog Number:
AG0046PV
Chemical Name:
5(4H)-Oxazolone, 4-[(9-ethyl-9H-carbazol-3-yl)methylene]-2-phenyl-
CAS Number:
88334-69-4
Molecular Formula:
C24H18N2O2
Molecular Weight:
366.4119
IUPAC Name:
4-[(9-ethylcarbazol-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one
InChI:
InChI=1S/C24H18N2O2/c1-2-26-21-11-7-6-10-18(21)19-14-16(12-13-22(19)26)15-20-24(27)28-23(25-20)17-8-4-3-5-9-17/h3-15H,2H2,1H3
InChI Key:
GSGPNUMQAUALMT-UHFFFAOYSA-N
SMILES:
CCn1c2ccc(cc2c2c1cccc2)C=C1N=C(OC1=O)c1ccccc1
Properties
Complexity:
664
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.137g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.42g/mol
Monoisotopic Mass:
366.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.3
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