Fmoc-4-amino-L-phenylalanine

C₂₄H₂₂N₂O₄CAS 95753-56-3402.45 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid Primary amine

Properties

Molecular formula: C₂₄H₂₂N₂O₄
Molar mass: 402.45 g/mol
Exact mass: 402.1580 Da
logP: 3.80Crippen estimate
Polar surface area: 101.6 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 6
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

95753-56-3

SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(C=C4)N)C(=O)O

InChIKey

VALNSJHHRPSUDO-QFIPXVFZSA-N

InChI

InChI=1S/C24H22N2O4/c25-16-11-9-15(10-12-16)13-22(23(27)28)26-24(29)30-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14,25H2,(H,26,29)(H,27,28)/t22-/m0/s1

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Work with Fmoc-4-amino-L-phenylalanine

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

Fmoc-phe-oh286460-71-782 % similar Fmoc-D-phenylalanine86123-10-682 % similar Fmoc-D-tyr-oh112883-29-180 % similar (2S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-hydroxyphenyl)propanoic acid92954-90-080 % similar Fmoc-L-4,4'-biphenylalanine199110-64-079 % similar Fmoc-D-4-carbamoylphe1217610-39-378 % similar Fmoc-D-4-chlorophe142994-19-277 % similar Fmoc-L-4-fluorophe169243-86-177 % similar

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

Elsewhere

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