chempirical

(Benzyloxycarbonyl)glycyl-L-proline

C15H18N2O5CAS 1160-54-9306.32 g/mol

Open in Covalent MOL file
OHONONHOO
AmideCarboxylic acid

Properties

Molecular formula
C15H18N2O5
Molar mass
306.32 g/mol
Exact mass
306.1216 Da
Melting point
156 °C
logP
1.19Crippen estimate
Polar surface area
99.4 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Hazards

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

Identifiers

CAS number
1160-54-9
SMILES
O=C(O)[C@@H]1CCCN1C(=O)CN=C(O)OCc1ccccc1
InChIKey
ZTUKZKYDJMGJDC-LBPRGKRZSA-N
InChI
InChI=1S/C15H18N2O5/c18-13(17-8-4-7-12(17)14(19)20)9-16-15(21)22-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,21)(H,19,20)/t12-/m0/s1

Weigh it out

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

Names and synonyms

7 names
  • L-Proline, N-[(phenylmethoxy)carbonyl]glycyl-
  • Proline, 1-(N-carboxyglycyl)-, N-benzyl ester, L-
  • L-Proline, 1-[N-[(phenylmethoxy)carbonyl]glycyl]-
  • N-[(Phenylmethoxy)carbonyl]glycyl-L-proline
  • Carbobenzoxyglycyl-L-proline
  • NSC 89634
  • Cbz-gly-pro-oh

Work with (Benzyloxycarbonyl)glycyl-L-proline

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-proline1148-11-465 % similar N-(Benzyloxycarbonyl)-D-proline6404-31-565 % similar 1-Cbz-2-piperidinecarboxylic acid28697-07-661 % similar (D)-N-(Benzyloxycarbonyl)pipecolic acid28697-09-861 % similar 1-Carbobenzoxy-2-piperidinecarboxylic Acid71170-88-261 % similar (2S)-1-(Benzyloxycarbonyl)azetidine-2-carboxylic acid25654-52-856 % similar N-[(Phenylmethoxy)carbonyl]glycyl-L-phenylalanine1170-76-955 % similar (S)-2-Hydroxy-4-(((phenylmethoxy)carbonyl)amino)butyric acid40371-50-454 % similar

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

Same formula

N6-Carbobenzoxy-L-lysine N-carboxyanhydride1676-86-4

Elsewhere

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