Telatinib

C₂₀H₁₆ClN₅O₃CAS 332012-40-5409.83 g/mol

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Amide Aryl halide Ether Secondary amine

Properties

Molecular formula: C₂₀H₁₆ClN₅O₃
Molar mass: 409.83 g/mol
Exact mass: 409.0942 Da
logP: 3.95Crippen estimate
Polar surface area: 102.2 Å²
H-bond donors / acceptors: 2 / 7
Rotatable bonds: 6

Identifiers

CAS number

332012-40-5

SMILES

CNC(=O)c1cc(COc2nnc(Nc3ccc(Cl)cc3)c3ccoc23)ccn1

InChIKey

QFCXANHHBCGMAS-UHFFFAOYSA-N

InChI

InChI=1S/C20H16ClN5O3/c1-22-19(27)16-10-12(6-8-23-16)11-29-20-17-15(7-9-28-17)18(25-26-20)24-14-4-2-13(21)3-5-14/h2-10H,11H2,1H3,(H,22,27)(H,24,25)

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Names and synonyms

3 names

2-Pyridinecarboxamide, 4-[[[4-[(4-chlorophenyl)amino]furo[2,3-d]pyridazin-7-yl]oxy]methyl]-N-methyl-
4-[[[4-[(4-Chlorophenyl)amino]furo[2,3-d]pyridazin-7-yl]oxy]methyl]-N-methyl-2-pyridinecarboxamide
Bay 57-9352

Work with Telatinib

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

4-Chloro-N-methylpicolinamide220000-87-342 % similar 2-Pyridinecarboxamide, 4-chloro-N-methyl-, hydrochloride (1:1)882167-77-341 % similar Vatalanib212141-54-333 % similar 4-(4-Aminophenoxy)-N-methylpicolinamide284462-37-932 % similar 4-(4-Amino-3-fluorophenoxy)-N-methylpyridine-2-carboxamide757251-39-132 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook