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Home > Indoles and Oxindole > 137501-13-4
137501-13-4 | 2H-Indol-2-one, 1,3-dihydro-3-(4-quinolinylmethylene)-
CAS No: 137501-13-4 Catalog No: AG0013EG MDL No:
Product Description
Catalog Number:
AG0013EG
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-(4-quinolinylmethylene)-
CAS Number:
137501-13-4
Molecular Formula:
C18H12N2O
Molecular Weight:
272.3007
IUPAC Name:
3-(quinolin-4-ylmethylidene)-1H-indol-2-one
InChI:
InChI=1S/C18H12N2O/c21-18-15(14-6-2-4-8-17(14)20-18)11-12-9-10-19-16-7-3-1-5-13(12)16/h1-11H,(H,20,21)
InChI Key:
UBEIHUVCYODJRE-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1=Cc1ccnc3c1cccc3)cccc2
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.307g/mol
Monoisotopic Mass:
272.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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