Boc-L-3,3-diphenylalanine

C₂₀H₂₃NO₄CAS 138662-63-2341.41 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid

Properties

Molecular formula: C₂₀H₂₃NO₄
Molar mass: 341.41 g/mol
Exact mass: 341.1627 Da
logP: 3.80Crippen estimate
Polar surface area: 75.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 5
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

138662-63-2

SMILES

CC(C)(C)OC(=O)N[C@@H](C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)O

InChIKey

TYJDOLCFYZSNQC-KRWDZBQOSA-N

InChI

InChI=1S/C20H23NO4/c1-20(2,3)25-19(24)21-17(18(22)23)16(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13,16-17H,1-3H3,(H,21,24)(H,22,23)/t17-/m0/s1

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Names and synonyms

1 names

Boc-3,3-diphenyl-L-alanine

Work with Boc-L-3,3-diphenylalanine

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

Boc-L-homophenylalanine100564-78-159 % similar Boc-L-phenylglycinol117049-14-657 % similar (S)-N-Boc-3-amino-3-phenylpropanoic acid103365-47-557 % similar Boc-L-cyclopentylglycine109183-72-457 % similar (R)-2-((tert-Butoxycarbonyl)amino)-2-(2-methoxyphenyl)acetic acid1217786-73-655 % similar Boc-D-cys(bzl)-oh102830-49-955 % similar Boc-N-beta-trityl-L-asparagine132388-68-255 % similar Boc-D-bpa-oh117666-94-153 % similar

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

Same formula

Boc-D-4,4'-biphenylalanine128779-47-5 Efaproxiral131179-95-8 Boc-L-4,4'-biphenylalanine147923-08-8 Naltrexone16590-41-3 (+)-Isocorydine475-67-2 1-[(3,4-Dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxyisoquinoline6957-27-3

Elsewhere

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