N-Boc-beta-phenyl-L-phenylalaninol

C₂₀H₂₅NO₃CAS 155836-47-8327.42 g/mol

Open in Covalent MOL file

Alcohol Carbamate

Properties

Molecular formula: C₂₀H₂₅NO₃
Molar mass: 327.42 g/mol
Exact mass: 327.1834 Da
logP: 3.70Crippen estimate
Polar surface area: 58.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 5
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

155836-47-8

SMILES

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

InChIKey

OGVCRJDQGBIHAG-QGZVFWFLSA-N

InChI

InChI=1S/C20H25NO3/c1-20(2,3)24-19(23)21-17(14-22)18(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17-18,22H,14H2,1-3H3,(H,21,23)/t17-/m1/s1

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Names and synonyms

1 names

(S)-tert-Butyl (3-hydroxy-1,1-diphenylpropan-2-yl)carbamate

Work with N-Boc-beta-phenyl-L-phenylalaninol

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-phenylglycinol117049-14-672 % similar N-Boc-L-cyclohexylglycinol107202-39-157 % similar N-Boc-(2S,3S)-(-)-2-amino-3-methyl-1-pentanol106946-74-155 % similar Nalpha-fmoc-L-serine tert-butyl ester110797-35-850 % similar (S)-(-)-2-(Boc-amino)-1,4-butanediol128427-10-149 % similar Boc-D-leucinol106930-51-248 % similar N-Boc-3-iodo-L-alanine benzyl ester108957-20-647 % similar Boc-D-4,4'-biphenylalanine128779-47-547 % similar

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

Same formula

Lcz696 intemediate1426129-50-1 1,1-Dimethylethyl N-[(1R)-1-(hydroxymethyl)-2,2-diphenylethyl]carbamate155836-48-9 2-[(1,1-Dimethylethyl)(phenylmethyl)amino]-1-[4-hydroxy-3-(hydroxymethyl)phenyl]ethanone64092-10-0

Elsewhere

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