Fmoc-S-4-methoxytrityl-L-cysteine

C₃₈H₃₃NO₅SCAS 177582-21-7615.74 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid Ether Sulfide

Properties

Molecular formula: C₃₈H₃₃NO₅S
Molar mass: 615.74 g/mol
Exact mass: 615.2079 Da
logP: 7.71Crippen estimate
Polar surface area: 84.9 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 11
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

177582-21-7

SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SC[C@@H](C(=O)O)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

InChIKey

LOBUWFUSGOYXQX-DHUJRADRSA-N

InChI

InChI=1S/C38H33NO5S/c1-43-29-22-20-28(21-23-29)38(26-12-4-2-5-13-26,27-14-6-3-7-15-27)45-25-35(36(40)41)39-37(42)44-24-34-32-18-10-8-16-30(32)31-17-9-11-19-33(31)34/h2-23,34-35H,24-25H2,1H3,(H,39,42)(H,40,41)/t35-/m0/s1

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Names and synonyms

1 names

Fmoc-cys(mmt)-oh

Work with Fmoc-S-4-methoxytrityl-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-Fmoc-S-trityl-D-cysteine167015-11-486 % similar N-Fmoc-S-(4-methoxybenzyl)-L-cysteine141892-41-372 % similar Fmoc-homocys(trt)-oh167015-23-871 % similar (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-6-(((4-Methoxyphenyl)diphenylmethyl)amino)hexanoic acid159857-60-070 % similar Fmoc-D-4-methoxyphe201335-88-869 % similar Fmoc-D-cys(tbu)-oh131766-22-869 % similar N-9-Fluorenylmethoxycarbonyl-se-4-methoxybenzylselenocysteine150308-80-864 % similar Fmoc-S-methyl-L-cysteine138021-87-164 % similar

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

Elsewhere

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