Basic information
- CAS
28369-60-0- Standard SMILES
COC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)OC(C)(C)C- InChIKey
QKXRHAOTMQGKPP-IUCAKERBSA-N- Molecular formula
- C14H25N3O6
- Average molar mass
- 331.36 g/mol
- Monoisotopic mass
- 331.17433553
Names & identifiers
- Preferred name
- Glycine, N-[(1,1-dimethylethoxy)carbonyl]-L-alanyl-L-alanyl-, methyl ester
- IUPAC
- methyl 2-[[(2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]propanoyl]amino]acetate
Names & synonyms
DTXSID401145590Glycine, N-[(1,1-dimethylethoxy)carbonyl]-L-alanyl-L-alanyl-, methyl ester28369-60-0Methyl N-(tert-butoxycarbonyl)-L-alanyl-L-alanylglycinate
Database identifiers
- CAS
28369-60-0- PubChem CID
- 12976554
- DTXSID
DTXSID401145590
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 458
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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