Z-Asp-obzl

C₁₉H₁₉NO₆CAS 4779-31-1357.36 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid Ester

Properties

Molecular formula: C₁₉H₁₉NO₆
Molar mass: 357.36 g/mol
Exact mass: 357.1212 Da
logP: 2.50Crippen estimate
Polar surface area: 101.9 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 8
Stereocentres: Sin SMILES atom order

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

4779-31-1

SMILES

C1=CC=C(C=C1)COC(=O)[C@H](CC(=O)O)NC(=O)OCC2=CC=CC=C2

InChIKey

UYOZWZKJQRBZRH-INIZCTEOSA-N

InChI

InChI=1S/C19H19NO6/c21-17(22)11-16(18(23)25-12-14-7-3-1-4-8-14)20-19(24)26-13-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,20,24)(H,21,22)/t16-/m0/s1

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Work with Z-Asp-obzl

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

Z-Asp-ome4668-42-282 % similar Cbz-L-glutamic acid 1-benzyl ester3705-42-878 % similar Z-D-Glu-OBzl65706-99-278 % similar Fmoc-L-aspartic acid-1-benzyl ester86060-83-578 % similar N-Carbobenzoxy-dl-aspartic acid4515-21-377 % similar (2R)-2-(((Benzyloxy)carbonyl)amino)butanedioic acid78663-07-777 % similar Benzyl N-((benzyloxy)carbonyl)-L-serinate21209-51-870 % similar (S)-Benzyl (2-oxooxetan-3-YL)carbamate26054-60-467 % similar

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

Same formula

4-(Phenylmethyl) hydrogen N-[(phenylmethoxy)carbonyl]-L-aspartate3479-47-8

Elsewhere

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