Basic information
- Standard SMILES
CCOC(=O)[C@H]1CCCN1C(=O)C(C)(C)c1cccc(OCc2nc(-c3ccccc3)oc2C)c1- InChIKey
NCPOCTIAJUIRJZ-XMMPIXPASA-N- Molecular formula
- C28H32N2O5
- Average molar mass
- 476.6 g/mol
Names & identifiers
- Preferred name
- (R)-{2-methyl-2-[3-(5-methyl-2-phenyl-oxazol-4-ylmethoxy)-phenyl]-propionyl}-pyrrolidine-2-carboxylic acid ethyl ester
- IUPAC
- ethyl (2R)-1-[2-methyl-2-[3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]propanoyl]pyrrolidine-2-carboxylate
Names & synonyms
SCHEMBL3522783NCPOCTIAJUIRJZ-XMMPIXPASA-N(R)-{2-methyl-2-[3-(5-methyl-2-phenyl-oxazol-4-ylmethoxy)-phenyl]-propionyl}-pyrrolidine-2-carboxylic acid ethyl ester(R)-1-{2-methyl-2-[3-(5-methyl-2-phenyl-oxazol-4-ylmethoxy)-phenyl]-propionyl}-pyrrolidine-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 68675740
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 81.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 722
Related reactions
2 records
Compound notes
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