chempirical

L-Leucyl-L-alanine

C9H18N2O3CAS 7298-84-2202.25 g/mol

Open in Covalent MOL file
NH2ONHOOH
Carboxylic acidPrimary amine

Properties

Molecular formula
C9H18N2O3
Molar mass
202.25 g/mol
Exact mass
202.1317 Da
Melting point
255–256 °C (decomposes)
logP
0.79Crippen estimate
Polar surface area
95.9 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
5
Stereocentres
S, 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
7298-84-2
SMILES
CC(C)C[C@H](N)C(O)=N[C@@H](C)C(=O)O
InChIKey
HSQGMTRYSIHDAC-BQBZGAKWSA-N
InChI
InChI=1S/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7-/m0/s1

Weigh it out

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

Names and synonyms

18 names · show all
  • 68: PN: WO2020097235 SEQID: 297 claimed protein
  • 52: PN: WO2021068040 SEQID: 67 claimed protein
  • L-Alanine, L-leucyl-
  • Alanine, N-L-leucyl-, L-
  • L-Alanine, N-L-leucyl-
  • Alanine, N-leucyl-
  • Leucylalanine
  • NSC 89180
  • 1970: PN: EP2071334 SEQID: 2077 claimed protein
  • 1970: PN: WO2009077864 SEQID: 2077 claimed protein
  • 1: PN: US20090239809 SEQID: 1 claimed protein
  • 90: PN: EP2161028 PAGE: 10 claimed protein
  • 25: PN: WO2011146121 PAGE: 114 claimed sequence
  • 104: PN: WO2013044298 SEQID: 131 unclaimed protein
  • 109: PN: WO2014102104 SEQID: 208 claimed protein
  • 109: PN: WO2014102101 SEQID: 409 claimed protein
  • 149: PN: WO2014102103 TABLE: 1 claimed protein
  • 128: PN: WO2014102100 TABLE: 1 claimed protein

Work with L-Leucyl-L-alanine

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

L-Leucyl-L-leucine3303-31-973 % similar D-Leucine328-38-162 % similar Leucine328-39-262 % similar Leucine61-90-562 % similar L-Alanyl-L-alanine1948-31-859 % similar DL-Alanyl-DL-alanine2867-20-159 % similar D-Alanyl-D-alanine923-16-059 % similar L-Phenylalanyl-L-alanine3918-87-459 % similar

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

Same formula

1,1-Dimethylethyl 3-(aminomethyl)-3-hydroxy-1-azetidinecarboxylate1008526-71-3 4-(2-Hydroxyethyl)-piperazin-1-carboxylic acid ethyl ester14000-66-9 (3R,4R)-tert-Butyl 3-amino-4-hydroxypyrrolidine-1-carboxylate148214-90-8 (3S,4S)-N-Boc-3-amino-4-hydroxypyrrolidine190792-74-6 DL-Alanyl-DL-leucine1999-42-4 L-Alanyl-L-leucine3303-34-2

Elsewhere

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