chempirical

N2-[(Phenylmethoxy)carbonyl]-L-glutamine

C13H16N2O5CAS 2650-64-8280.28 g/mol

Open in Covalent MOL file
NH2ONHOOOOH
Carboxylic acid

Properties

Molecular formula
C13H16N2O5
Molar mass
280.28 g/mol
Exact mass
280.1059 Da
Melting point
136–137 °C
logP
1.89Crippen estimate
Polar surface area
123.2 Ų
H-bond donors / acceptors
4 / 4
Rotatable bonds
7
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
2650-64-8
SMILES
N=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(=O)O
InChIKey
JIMLDJNLXLMGLX-JTQLQIEISA-N
InChI
InChI=1S/C13H16N2O5/c14-11(16)7-6-10(12(17)18)15-13(19)20-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,16)(H,15,19)(H,17,18)/t10-/m0/s1

Weigh it out

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

Names and synonyms

15 names · show all
  • L-Glutamine, N2-[(phenylmethoxy)carbonyl]-
  • Glutamine, N2-carboxy-, N2-benzyl ester, L-
  • Glutamine, N2-carboxy-, N-benzyl ester
  • Carbobenzoxy-L-glutamine
  • Benzyloxycarbonyl-L-glutamine
  • Nα-Benzyloxycarbonyl-L-glutamine
  • N2-Carbobenzoxy-L-glutamine
  • N-Carbobenzoxy-L-glutamine
  • N-(Benzyloxycarbonyl)-L-glutamine
  • N2-Benzyloxycarbonyl-L-glutamine
  • N2-Benzoxycarbonyl-L-glutamine
  • NSC 186903
  • Cbz-L-glutamine
  • (2S)-5-Amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid
  • (2S)-2-[[(Benzyloxy)carbonyl]amino]-4-carbamoylbutanoic acid

Work with N2-[(Phenylmethoxy)carbonyl]-L-glutamine

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

N2-[(Phenylmethoxy)carbonyl]-L-asparagine2304-96-379 % similar 5-(Phenylmethyl) hydrogen N-[(phenylmethoxy)carbonyl]-L-glutamate5680-86-477 % similar 5-(Phenylmethyl) hydrogen N-[(phenylmethoxy)carbonyl]-D-glutamate59486-73-677 % similar N-(Benzyloxycarbonyl)-L-glutamic acid1155-62-075 % similar N-[(Phenylmethoxy)carbonyl]norvaline21691-43-069 % similar N-[(Phenylmethoxy)carbonyl]-L-norvaline21691-44-169 % similar N2,N6-Bis[(phenylmethoxy)carbonyl]-L-lysine405-39-069 % similar Benzyloxycarbonyl-L-phenylalanine1161-13-368 % similar

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

Same formula

Z-D-Gln-oh13139-52-1 L-Aspartyl-L-phenylalanine13433-09-5 4-Butyrylamino-3-methyl-5-nitrobenzoic acid methyl ester152628-01-8

Elsewhere

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