N-(2-Oxoindolin-5-yl)acetamide - CAS 114741-27-4

Catalog:	BB058695
Product Name:	N-(2-Oxoindolin-5-yl)acetamide
CAS:	114741-27-4
Synonyms:	N-(2,3-Dihydro-2-oxo-1H-indol-5-yl)acetamide;5-(Acetylamino)-2-indolinone

Technical Data

IUPAC Name:	N-(2-oxo-1,3-dihydroindol-5-yl)acetamide
Description:	N-(2-Oxoindolin-5-yl)acetamide (cas# 114741-27-4) is used as a reactant or reagent in preparation of (indolylmethylene) indolinones as protein kinase/phosphatase inhibitors for treatment of proliferative diseases.
Molecular Weight:	190.2
Molecular Formula:	C10H10N2O2
Canonical SMILES:	CC(=O)NC1=CC2=C(C=C1)NC(=O)C2
InChI:	InChI=1S/C10H10N2O2/c1-6(13)11-8-2-3-9-7(4-8)5-10(14)12-9/h2-4H,5H2,1H3,(H,11,13)(H,12,14)
InChI Key:	GAPFXVWCGZCQPI-UHFFFAOYSA-N
References:	Tang, Peng Cho, et al. PCT Int. Appl.,Patent,199 pp.(2001).

Complexity:	265
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.074227566
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	190.074227566
Rotatable Bond Count:	1
Topological Polar Surface Area:	58.2Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.1