Fmoc-D-ala-opfp

C₂₄H₁₆F₅NO₄CAS 125043-04-1477.39 g/mol

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Aryl halide Carbamate Ester

Properties

Molecular formula: C₂₄H₁₆F₅NO₄
Molar mass: 477.39 g/mol
Exact mass: 477.0999 Da
logP: 5.21Crippen estimate
Polar surface area: 64.6 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 5
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

125043-04-1

SMILES

C[C@H](C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChIKey

CJXZXBGKOSXBFR-LLVKDONJSA-N

InChI

InChI=1S/C24H16F5NO4/c1-11(23(31)34-22-20(28)18(26)17(25)19(27)21(22)29)30-24(32)33-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16H,10H2,1H3,(H,30,32)/t11-/m1/s1

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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-cys(trt)-opfp115520-21-363 % similar Fmoc-asn(trt)-opfp132388-64-862 % similar 1-(9H-Fluoren-9-ylmethyl) 2-(pentafluorophenyl) (2S)-1,2-pyrrolidinedicarboxylate86060-90-455 % similar N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-methionine 2,3,4,5,6-pentafluorophenyl ester86060-94-852 % similar N-[(9H-Fluoren-9-ylmethoxy)carbonyl]glycine 2,3,4,5,6-pentafluorophenyl ester86060-85-751 % similar Fmoc-val-osu130878-68-150 % similar Nalpha-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-threonine tert-Butyl Ester120791-76-649 % similar L-Cysteine, S-[(acetylamino)methyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, pentafluorophenyl ester86060-96-049 % similar

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

Same formula

Fmoc-D-pentafluorophenylalanine198545-85-6 Fmoc-pentafluoro-L-phenylalanine205526-32-5

Elsewhere

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