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210303-07-4 | 2H-Indol-2-one, 1,3-dihydro-3-(1H-pyrrol-2-ylmethylene)-, (3Z)-
CAS No: 210303-07-4 Catalog No: AG002KP3 MDL No:
Product Description
Catalog Number:
AG002KP3
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-(1H-pyrrol-2-ylmethylene)-, (3Z)-
CAS Number:
210303-07-4
Molecular Formula:
C13H10N2O
Molecular Weight:
210.2313
IUPAC Name:
3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one
InChI:
InChI=1S/C13H10N2O/c16-13-11(8-9-4-3-7-14-9)10-5-1-2-6-12(10)15-13/h1-8,14H,(H,15,16)
InChI Key:
SEZFNTZQMWJIAI-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(/C/1=C/c1[nH]ccc1)cccc2
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.236g/mol
Monoisotopic Mass:
210.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Synthesis and biological evaluations of 3-substituted indolin-2-ones: a novel class of tyrosine kinase inhibitors that exhibit selectivity toward particular receptor tyrosine kinases. | Journal of medicinal chemistry 19980702 |
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