Fmoc-3,3-diphenyl-L-alanine

C₃₀H₂₅NO₄CAS 201484-50-6463.53 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid

Properties

Molecular formula: C₃₀H₂₅NO₄
Molar mass: 463.53 g/mol
Exact mass: 463.1784 Da
logP: 5.81Crippen estimate
Polar surface area: 75.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 7
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

201484-50-6

SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChIKey

PENQOTJCVODUQU-NDEPHWFRSA-N

InChI

InChI=1S/C30H25NO4/c32-29(33)28(27(20-11-3-1-4-12-20)21-13-5-2-6-14-21)31-30(34)35-19-26-24-17-9-7-15-22(24)23-16-8-10-18-25(23)26/h1-18,26-28H,19H2,(H,31,34)(H,32,33)/t28-/m0/s1

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Names and synonyms

1 names

Fmoc-beta-phenyl-Phe-OH

Work with Fmoc-3,3-diphenyl-L-alanine

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-L-phenylglycine102410-65-176 % similar Fmoc-D-phg-oh111524-95-976 % similar (2R,3S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-hydroxybutanoic acid157355-81-270 % similar Fmoc-chg-oh161321-36-470 % similar Fmoc-D-chg-oh198543-96-370 % similar Fmoc-D-allo-ile-oh118904-37-367 % similar Fmoc-D-ile-oh143688-83-967 % similar (2S,3S)-Fmoc-abu(3-N3)-oh131669-42-664 % similar

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

Same formula

Fmoc-L-4,4'-biphenylalanine199110-64-0 (αR)-α-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino][1,1′-biphenyl]-4-propanoic acid205526-38-1

Elsewhere

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