Basic information
- Standard SMILES
COC(=O)c1cnc([C@H](C)NC(=O)OC(C)(C)C)[nH]1- InChIKey
ZZQDRIPMZWBPNL-ZETCQYMHSA-N- Molecular formula
- C12H19N3O4
- Average molar mass
- 269.3 g/mol
Names & identifiers
- Preferred name
- 2-((S)-1-tert-butoxycarbonylamino-ethyl)-3H-imidazole-4-carboxylic acid methyl ester
- IUPAC
- methyl 2-[(1S)-1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1H-imidazole-5-carboxylate
Names & synonyms
SCHEMBL14738789ZZQDRIPMZWBPNL-ZETCQYMHSA-N2-((S)-1-tert-butoxycarbonylamino-ethyl)-3H-imidazole-4-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 71280301
- Nikkaji
- J2.706.269E
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 93.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
1 records
Compound notes
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