Fmoc-L-4-methylphe

C₂₅H₂₃NO₄CAS 199006-54-7401.46 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid

Properties

Molecular formula: C₂₅H₂₃NO₄
Molar mass: 401.46 g/mol
Exact mass: 401.1627 Da
logP: 4.53Crippen estimate
Polar surface area: 75.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 6
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

199006-54-7

SMILES

CC1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChIKey

UXLHLZHGQPDMJQ-QHCPKHFHSA-N

InChI

InChI=1S/C25H23NO4/c1-16-10-12-17(13-11-16)14-23(24(27)28)26-25(29)30-15-22-20-8-4-2-6-18(20)19-7-3-5-9-21(19)22/h2-13,22-23H,14-15H2,1H3,(H,26,29)(H,27,28)/t23-/m0/s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

Fmoc-4-methyl-L-phenylalanine

Work with Fmoc-L-4-methylphe

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-D-tyr-oh112883-29-180 % similar Fmoc-L-4,4'-biphenylalanine199110-64-079 % similar Fmoc-D-4-methoxyphe201335-88-878 % similar Fmoc-D-4-chlorophe142994-19-277 % similar Fmoc-L-4-fluorophe169243-86-177 % similar (S)-N-Fmoc-4-chlorophenylalanine175453-08-477 % similar (S)-N-Fmoc-4-bromophenylalanine198561-04-577 % similar Fmoc-cys(4-mbzl)-oh136050-67-477 % similar

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

Same formula

Fmoc-L-homophenylalanine132684-59-4 Fmoc-alpha-methyl-L-phe135944-05-7 Fmoc-D-homophenylalanine135944-09-1 Fmoc-D-homophenylalanine135994-09-1 Fmoc-N-methyl-D-phenylalanine138775-05-0 Fmoc-L-beta-homophenylalanine193954-28-8 Fmoc-D-4-methylphe204260-38-8 (βR)-β-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]benzenebutanoic acid209252-16-4

Elsewhere

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