S-Cbz-L-cysteine

C₁₁H₁₃NO₄SCAS 1625-72-5255.29 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine Sulfide

Properties

Molecular formula: C₁₁H₁₃NO₄S
Molar mass: 255.29 g/mol
Exact mass: 255.0565 Da
logP: 1.47Crippen estimate
Polar surface area: 89.6 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 5
Stereocentres: Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

1625-72-5

SMILES

C1=CC=C(C=C1)COC(=O)SC[C@@H](C(=O)O)N

InChIKey

IAZGSEXFFGHKDF-VIFPVBQESA-N

InChI

InChI=1S/C11H13NO4S/c12-9(10(13)14)7-17-11(15)16-6-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,14)/t9-/m0/s1

Weigh it out

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

Names and synonyms

1 names

(R)-2-Amino-3-(((benzyloxy)carbonyl)thio)propanoic acid

Work with S-Cbz-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

H-D-Asp(obzl)-oh13188-89-162 % similar 4-(Phenylmethyl) hydrogen L-aspartate2177-63-162 % similar γ-Benzyl L-glutamate1676-73-960 % similar 5-(Phenylmethyl) hydrogen D-glutamate2578-33-860 % similar O-(Phenylmethyl)-D-serine10433-52-059 % similar H-D-Cys(bzl)-oh23032-53-359 % similar S-Benzyl-L-cysteine3054-01-159 % similar O-Benzyl-L-serine4726-96-959 % similar

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

Elsewhere

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