Indirubin-3'-monoxime

C₁₆H₁₁N₃O₂CAS 160807-49-8277.28 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₆H₁₁N₃O₂
Molar mass: 277.28 g/mol
Exact mass: 277.0851 Da
logP: 4.42Crippen estimate
Polar surface area: 81.2 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

160807-49-8

SMILES

C1=CC=C2C(=C1)C(=C(N2)O)C3=C(C4=CC=CC=C4N3)N=O

InChIKey

FQCPPVRJPILDIK-UHFFFAOYSA-N

InChI

InChI=1S/C16H11N3O2/c20-16-13(9-5-1-3-7-11(9)18-16)15-14(19-21)10-6-2-4-8-12(10)17-15/h1-8,17-18,20H

Weigh it out

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Work with Indirubin-3'-monoxime

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

1-Nitroso-2-naphthol131-91-937 % similar Carbazole86-74-834 % similar Acridone578-95-033 % similar 2-Phenylindole-3-carboxaldehyde25365-71-333 % similar 4-Hydroxycarbazole52602-39-833 % similar 2-Hydroxycarbazole86-79-333 % similar 2-Amino-4-hydroxyquinoline42712-64-132 % similar 5-Bromo-7H-benzo(c)carbazole131409-18-231 % similar

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

Same formula

2,2':6',2''-Terpyridine-4'-carboxylic acid148332-36-9

Elsewhere

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