(2S)-6-Azido-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid

C₂₁H₂₂N₄O₄CAS 159610-89-6394.43 g/mol

Open in Covalent MOL file

Azide Carbamate Carboxylic acid

Properties

Molecular formula: C₂₁H₂₂N₄O₄
Molar mass: 394.43 g/mol
Exact mass: 394.1641 Da
logP: 4.46Crippen estimate
Polar surface area: 124.4 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 9
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

159610-89-6

SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCCCN=[N+]=[N-])C(=O)O

InChIKey

PJRFTUILPGJJIO-IBGZPJMESA-N

InChI

InChI=1S/C21H22N4O4/c22-25-23-12-6-5-11-19(20(26)27)24-21(28)29-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,24,28)(H,26,27)/t19-/m0/s1

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Names and synonyms

1 names

Fmoc-lys(N3)-oh

Work with (2S)-6-Azido-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid

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-lys-oh105047-45-869 % similar Fmoc-D-nle-oh112883-41-768 % similar Fmoc-cha-oh135673-97-167 % similar Fmoc-D-arg-oh130752-32-867 % similar Nalpha-fmoc-L-lysine hydrochloride139262-23-066 % similar Fmoc-D-lys-oh hcl201002-47-366 % similar Fmoc-L-norvaline135112-28-665 % similar (2R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)pentanoic acid144701-24-665 % similar

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

Elsewhere

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