chempirical

N-[(Phenylmethoxy)carbonyl]glycyl-L-phenylalanine

C19H20N2O5CAS 1170-76-9356.38 g/mol

Open in Covalent MOL file
OHONHONHOO
Carboxylic acid

Properties

Molecular formula
C19H20N2O5
Molar mass
356.38 g/mol
Exact mass
356.1372 Da
Melting point
125–126 °C
logP
2.77Crippen estimate
Polar surface area
111.7 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
8
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
1170-76-9
SMILES
O=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)OCc1ccccc1
InChIKey
FLGYJBNDDWLTQR-INIZCTEOSA-N
InChI
InChI=1S/C19H20N2O5/c22-17(12-20-19(25)26-13-15-9-5-2-6-10-15)21-16(18(23)24)11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,20,25)(H,21,22)(H,23,24)/t16-/m0/s1

Weigh it out

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

Names and synonyms

14 names · show all
  • L-Phenylalanine, N-[(phenylmethoxy)carbonyl]glycyl-
  • Alanine, N-(N-carboxyglycyl)-3-phenyl-, N-benzyl ester, L-
  • L-Phenylalanine, N-[N-[(phenylmethoxy)carbonyl]glycyl]-
  • L-Alanine, N-(N-carboxyglycyl)-3-phenyl-, N-benzyl ester
  • (Carbobenzoxy)glycyl-L-phenylalanine
  • N-(Benzyloxycarbonyl)glycyl-L-phenylalanine
  • (Carbobenzyloxy)glycyl-L-phenylalanine
  • N-(Carbobenzoxy)glycyl-L-phenylalanine
  • N-(Carbobenzyloxy)glycyl-L-phenylalanine
  • (Carbobenzoxy)glycylphenylalanine
  • N-(Benzyloxycarbonyl)glycylphenylalanine
  • NSC 89642
  • (2S)-2-[[2-(Benzyloxycarbonylamino)acetyl]amino]-3-phenyl-propanoic acid
  • (2S)-3-Phenyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoic acid

Work with N-[(Phenylmethoxy)carbonyl]glycyl-L-phenylalanine

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

Benzyloxycarbonyl-L-phenylalanine1161-13-376 % similar N-(Benzyloxycarbonyl)-D-phenylalanine2448-45-576 % similar N-(Benzyloxycarbonyl)-dl-phenylalanine3588-57-676 % similar Carbobenzoxy-L-tyrosine1164-16-568 % similar Glycylphenylalanine3321-03-760 % similar Glycylphenylalanine721-66-460 % similar N-(Benzyloxycarbonyl)-L-serine1145-80-860 % similar N-Benzyloxycarbonyl-dl-serine2768-56-160 % similar

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

Elsewhere

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