chempirical

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

C32H30N2O5CAS 132388-60-4522.60 g/mol

Open in Covalent MOL file
OHOONHHNOO
Carboxylic acid

Properties

Molecular formula
C32H30N2O5
Molar mass
522.60 g/mol
Exact mass
522.2155 Da
logP
6.30Crippen estimate
Polar surface area
111.7 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
11
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
132388-60-4
SMILES
O=C(O)[C@H](CCC(O)=NC(c1ccccc1)(c1ccccc1)c1ccccc1)N=C(O)OCc1ccccc1
InChIKey
MYOAIKMOWHPBQS-NDEPHWFRSA-N
InChI
InChI=1S/C32H30N2O5/c35-29(22-21-28(30(36)37)33-31(38)39-23-24-13-5-1-6-14-24)34-32(25-15-7-2-8-16-25,26-17-9-3-10-18-26)27-19-11-4-12-20-27/h1-20,28H,21-23H2,(H,33,38)(H,34,35)(H,36,37)/t28-/m0/s1

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Names and synonyms

2 names
  • L-Glutamine, N2-[(phenylmethoxy)carbonyl]-N-(triphenylmethyl)-
  • (2S)-5-Oxo-2-(phenylmethoxycarbonylamino)-5-(tritylamino)pentanoic acid

Work with N2-[(Phenylmethoxy)carbonyl]-N-(triphenylmethyl)-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-[(9H-Fluoren-9-ylmethoxy)carbonyl]-N-(triphenylmethyl)-L-glutamine132327-80-171 % similar 5-(Phenylmethyl) hydrogen N-[(phenylmethoxy)carbonyl]-L-glutamate5680-86-469 % similar 5-(Phenylmethyl) hydrogen N-[(phenylmethoxy)carbonyl]-D-glutamate59486-73-669 % similar N-(Benzyloxycarbonyl)-L-glutamic acid1155-62-068 % similar N-[(Phenylmethoxy)carbonyl]norvaline21691-43-066 % similar N-[(Phenylmethoxy)carbonyl]-L-norvaline21691-44-166 % similar N2-[(Phenylmethoxy)carbonyl]-L-glutamine2650-64-865 % similar N2,N6-Bis[(phenylmethoxy)carbonyl]-L-lysine405-39-065 % similar

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

Elsewhere

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