Fmoc-(R)-3-amino-3-(2-furyl)-propionic acid

C22H19NO5CAS 1217662-55-9377.40 g/mol

Open in Covalent MOL file
OONHOOHO
CarbamateCarboxylic acid

Properties

Molecular formula
C22H19NO5
Molar mass
377.40 g/mol
Exact mass
377.1263 Da
logP
4.33Crippen estimate
Polar surface area
88.8 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
6
Stereocentres
Rin SMILES atom order

Hazards

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

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Identifiers

CAS number
1217662-55-9
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC(=O)O)C4=CC=CO4
InChIKey
WNBKREXSNCMGTJ-LJQANCHMSA-N
InChI
InChI=1S/C22H19NO5/c24-21(25)12-19(20-10-5-11-27-20)23-22(26)28-13-18-16-8-3-1-6-14(16)15-7-2-4-9-17(15)18/h1-11,18-19H,12-13H2,(H,23,26)(H,24,25)/t19-/m1/s1

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Names and synonyms

1 names
  • (R)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(furan-2-yl)propanoic acid

Work with Fmoc-(R)-3-amino-3-(2-furyl)-propionic 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-(S)-3-amino-3-phenylpropionic acid209252-15-373 % similar Fmoc-(R)-3-amino-3-phenylpropionic acid220498-02-273 % similar (S)-3-((((9H-Fluoren-9-YL)methoxy)carbonyl)amino)-3-(4-chlorophenyl)propanoic acid479064-91-069 % similar (3R)-3-(4-Chlorophenyl)-3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)propanoic acid479064-92-169 % similar Fmoc-(S)-3-amino-3-(4-bromo-phenyl)-propionic acid220497-68-766 % similar Fmoc-L-beta-homoalanine193954-26-664 % similar Fmoc-(R)-3-amino-3-(3-pyridyl)-propionic acid511272-43-864 % similar Fmoc-L-aspartic acid119062-05-463 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Fmoc-L-2-furylalanine159611-02-6 (αR)-α-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-2-furanpropanoic acid220497-85-8

Elsewhere

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