(2E)-2-Cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-2-propenamide

C₁₇H₁₄N₂O₃CAS 133550-30-8294.31 g/mol

Open in Covalent MOL file

Alcohol Nitrile

Properties

Molecular formula: C₁₇H₁₄N₂O₃
Molar mass: 294.31 g/mol
Exact mass: 294.1004 Da
logP: 3.16Crippen estimate
Polar surface area: 96.8 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 4

Identifiers

CAS number

133550-30-8

SMILES

N#C/C(=Cc1ccc(O)c(O)c1)C(O)=NCc1ccccc1

InChIKey

TUCIOBMMDDOEMM-RIYZIHGNSA-N

InChI

InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)/b14-8+

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

Names and synonyms

4 names

2-Propenamide, 2-cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-, (2E)-
2-Propenamide, 2-cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-, (E)-
AG 490
Tyrphostin AG 490

Work with (2E)-2-Cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-2-propenamide

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

Same formula

5-Phenyl-1-(phenylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione72846-00-5

Elsewhere

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