chempirical

Cbz-N-methyl-L-phenylalanine

C18H19NO4CAS 2899-07-2313.35 g/mol

Open in Covalent MOL file
NOHOOO
CarbamateCarboxylic acid

Properties

Molecular formula
C18H19NO4
Molar mass
313.35 g/mol
Exact mass
313.1314 Da
logP
2.95Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
6
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
2899-07-2
SMILES
CN([C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)OCC2=CC=CC=C2
InChIKey
JDGXKNMKNMSHRJ-INIZCTEOSA-N
InChI
InChI=1S/C18H19NO4/c1-19(18(22)23-13-15-10-6-3-7-11-15)16(17(20)21)12-14-8-4-2-5-9-14/h2-11,16H,12-13H2,1H3,(H,20,21)/t16-/m0/s1

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Names and synonyms

1 names
  • Z-N-Me-phe-OH

Work with Cbz-N-methyl-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

N-Cbz-N-methyl-L-leucine33099-08-076 % similar Boc-N-methyl-L-phenylalanine37553-65-472 % similar N-Boc-N-methyl-D-phenylalanine85466-66-672 % similar Z-N-Me-ala-OH21691-41-871 % similar Fmoc-N-methyl-D-phenylalanine138775-05-070 % similar (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-3-phenylpropanoic acid77128-73-570 % similar N-Methyl-N-[(phenylmethoxy)carbonyl]-L-valine42417-65-268 % similar N-[(1,1-Dimethylethoxy)carbonyl]-N-methyl-O-(phenylmethyl)-L-tyrosine64263-81-667 % similar

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

Same formula

Kresoxim-methyl143390-89-0 (+)-Norisoboldine23599-69-1 N-Benzoyl-L-tyrosine ethyl ester3483-82-7 2-[4-(Diethylamino)-2-hydroxybenzoyl]benzoic acid5809-23-4 (+)-Laurolitsine5890-18-6 Feruloyltyramine66648-43-9

Elsewhere

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