(Z)-2-(2-Aminothiazol-4-yl)-2-((trityloxy)imino)acetic acid

C24H19N3O3SCAS 128438-01-7429.49 g/mol

Open in Covalent MOL file
ONSNNH2OOH
Carboxylic acidOximePrimary amine

Properties

Molecular formula
C24H19N3O3S
Molar mass
429.49 g/mol
Exact mass
429.1147 Da
logP
4.52Crippen estimate
Polar surface area
97.8 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
7
Double bonds
ZE/Z, in SMILES order

Hazards

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

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Identifiers

CAS number
128438-01-7
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O/N=C(/C4=CSC(=N4)N)\C(=O)O
InChIKey
XEZIFGWTSLOMMT-MEFGMAGPSA-N
InChI
InChI=1S/C24H19N3O3S/c25-23-26-20(16-31-23)21(22(28)29)27-30-24(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H,(H2,25,26)(H,28,29)/b27-21-

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Names and synonyms

1 names
  • (Z)-2-(2-Aminothiazole-4-yl-)-2-trityloxyimino acetic acid

Work with (Z)-2-(2-Aminothiazol-4-yl)-2-((trityloxy)imino)acetic acid

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

2-[(2-Aminothiazol-4-yl)carboxymethyleneaminooxy]-2-methylpropionic acid80542-76-367 % similar (Z)-2-(2-Aminothiazol-4-yl)-2-carboxymethoxyiminoacetic acid74440-05-458 % similar (Z)-2-(2-Aminothiazol-4-yl)-2-(tert-butoxycarbonylmethoxyimino)acetic acid74440-02-154 % similar (αZ)-α-[[2-(1,1-Dimethylethoxy)-1,1-dimethyl-2-oxoethoxy]imino]-2-[(triphenylmethyl)amino]-4-thiazoleacetic acid68672-66-249 % similar (E)-2-(((2-(2-Aminothiazol-4-yl)-3-oxo-3-((2-oxoethyl)amino)prop-1-en-1-yl)amino)oxy)-2-methylpropanoic acid194241-83-345 % similar 2-Aminothiazole-4-carboxylic acid40283-41-844 % similar Ethyl 2-(2-aminothiazole-4-yl)-2-(1-tert-butoxycarbonyl-1-methylethoxyimino)acetate86299-46-940 % similar tert-Butyl 2-(((1-(2-aminothiazol-4-yl)-2-(benzo[d]thiazol-2-ylthio)-2-oxoethylidene)amino)oxy)-2-methylpropanoate158183-05-240 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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