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Home > Indoles and Oxindole > 84640-80-2
84640-80-2 | 3-(5-PHENYL-1,3,4-OXADIAZOL-2-YLIMINO)-2-INDOLINONE
CAS No: 84640-80-2 Catalog No: AG0050FZ MDL No:
Product Description
Catalog Number:
AG0050FZ
Chemical Name:
3-(5-PHENYL-1,3,4-OXADIAZOL-2-YLIMINO)-2-INDOLINONE
CAS Number:
84640-80-2
Molecular Formula:
C16H10N4O2
Molecular Weight:
290.2762
IUPAC Name:
(3Z)-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]-1H-indol-2-one
InChI:
InChI=1S/C16H10N4O2/c21-14-13(11-8-4-5-9-12(11)17-14)18-16-20-19-15(22-16)10-6-2-1-3-7-10/h1-9H,(H,17,18,20,21)
InChI Key:
DUOJLCAFEKDDJW-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1=Nc1nnc(o1)c1ccccc1)cccc2
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
290.08g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.282g/mol
Monoisotopic Mass:
290.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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