N-[(1,1-Dimethylethoxy)carbonyl]-S-(9H-fluoren-9-ylmethyl)-L-cysteine

C₂₂H₂₅NO₄SCAS 84888-35-7399.51 g/mol

Open in Covalent MOL file

Carboxylic acid Sulfide

Properties

Molecular formula: C₂₂H₂₅NO₄S
Molar mass: 399.51 g/mol
Exact mass: 399.1504 Da
logP: 4.71Crippen estimate
Polar surface area: 79.1 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 6
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

84888-35-7

SMILES

CC(C)(C)OC(O)=N[C@@H](CSCC1c2ccccc2-c2ccccc21)C(=O)O

InChIKey

AIZZGGDXFGAYMR-IBGZPJMESA-N

InChI

InChI=1S/C22H25NO4S/c1-22(2,3)27-21(26)23-19(20(24)25)13-28-12-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,18-19H,12-13H2,1-3H3,(H,23,26)(H,24,25)/t19-/m0/s1

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Names and synonyms

1 names

L-Cysteine, N-[(1,1-dimethylethoxy)carbonyl]-S-(9H-fluoren-9-ylmethyl)-

Work with N-[(1,1-Dimethylethoxy)carbonyl]-S-(9H-fluoren-9-ylmethyl)-L-cysteine

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

N-tert-Butoxycarbonyl-S-benzyl-L-cysteine5068-28-069 % similar N-[(1,1-Dimethylethoxy)carbonyl]-3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-D-alanine131570-56-467 % similar N-[(1,1-Dimethylethoxy)carbonyl]-S-(triphenylmethyl)-L-cysteine21947-98-863 % similar Fmoc-L-asp(otbu)-oh71989-14-562 % similar N-(9-Fluorenylmethoxycarbonyl)-L-glutamic acid γ-tert-butyl ester71989-18-961 % similar N-(9-Fluorenylmethoxycarbonyl)-O-tert-butylserine71989-33-860 % similar N-α-Fluorenylmethoxycarbonyl-N-δ-tert-butoxycarbonyl-L-ornithine109425-55-060 % similar Fmoc-lys(boc)-oh71989-26-959 % similar

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

Same formula

Fmoc-D-cys(tbu)-oh131766-22-8

Elsewhere

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