Basic information
- Standard SMILES
CCOCC(COCC)OC(=O)n1ccnc1[C@@H](C)c1cccc(C)c1C- InChIKey
JRPZOXLSEPMMER-KRWDZBQOSA-N- Molecular formula
- C21H30N2O4
- Average molar mass
- 374.5 g/mol
- Monoisotopic mass
- 374.22055744
Names & identifiers
- Preferred name
- 2-ethoxy-1-(ethoxymethyl)ethyl 2-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1h-imidazole-1-carboxylate
- IUPAC
- 1,3-diethoxypropan-2-yl 2-[(1S)-1-(2,3-dimethylphenyl)ethyl]imidazole-1-carboxylate
Names & synonyms
SCHEMBL698841JRPZOXLSEPMMER-KRWDZBQOSA-N2-ethoxy-1-(ethoxymethyl)ethyl 2-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1h-imidazole-1-carboxylate
Database identifiers
- PubChem CID
- 57718381
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 440
Related reactions
2 records
Compound notes
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