3-(3,5-Dibromo-4-hydroxybenzylidene)-5-iodo-1,3-dihydroindol-2-one

C₁₅H₈Br₂INO₂CAS 220904-83-6520.95 g/mol

Open in Covalent MOL file

Alkene Amide Aryl halide Lactam Phenol

Properties

Molecular formula: C₁₅H₈Br₂INO₂
Molar mass: 520.95 g/mol
Exact mass: 518.7967 Da
logP: 5.01Crippen estimate
Polar surface area: 49.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

220904-83-6

SMILES

O=C1Nc2ccc(I)cc2C1=Cc1cc(Br)c(O)c(Br)c1

InChIKey

LMXYVLFTZRPNRV-UHFFFAOYSA-N

InChI

InChI=1S/C15H8Br2INO2/c16-11-4-7(5-12(17)14(11)20)3-10-9-6-8(18)1-2-13(9)19-15(10)21/h1-6,20H,(H,19,21)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

2H-Indol-2-one, 3-[(3,5-dibromo-4-hydroxyphenyl)methylene]-1,3-dihydro-5-iodo-
3-[(3,5-Dibromo-4-hydroxyphenyl)methylene]-1,3-dihydro-5-iodo-2H-indol-2-one
GW 5074

Work with 3-(3,5-Dibromo-4-hydroxybenzylidene)-5-iodo-1,3-dihydroindol-2-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Iodoisatin20780-76-148 % similar 3-(3,4-Dichlorobenzylidene)indolin-2-one114727-43-438 % similar 3,5-Dibromo-4-hydroxybenzaldehyde2973-77-535 % similar 5-Bromoisatin87-48-934 % similar 3,4′,5-Tribromosalicylanilide87-10-532 % similar 5-Methoxyisatin39755-95-832 % similar 5-Iodosalicylic acid119-30-232 % similar 3,5-Dibromo-4-hydroxybenzoic acid3337-62-031 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook