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Home > Indoles and Oxindole > 33546-08-6
33546-08-6 | 2H-Indol-2-one, 1,3-dihydro-1-phenyl-3-(4-pyridinylmethylene)-
CAS No: 33546-08-6 Catalog No: AG007EY4 MDL No:MFCD23703760
Product Description
Catalog Number:
AG007EY4
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-1-phenyl-3-(4-pyridinylmethylene)-
CAS Number:
33546-08-6
Molecular Formula:
C20H14N2O
Molecular Weight:
298.3380
MDL Number:
MFCD23703760
IUPAC Name:
1-phenyl-3-(pyridin-4-ylmethylidene)indol-2-one
InChI:
InChI=1S/C20H14N2O/c23-20-18(14-15-10-12-21-13-11-15)17-8-4-5-9-19(17)22(20)16-6-2-1-3-7-16/h1-14H
InChI Key:
HMXDQCMVHFYIDF-UHFFFAOYSA-N
SMILES:
O=C1C(=Cc2ccncc2)c2c(N1c1ccccc1)cccc2
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.111g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.345g/mol
Monoisotopic Mass:
298.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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