Basic information
- Standard SMILES
COC(=O)Cc1ccc2nc(-c3cn(C)c4ccccc34)oc2c1- InChIKey
OJBQKTGRJXLCDJ-UHFFFAOYSA-N- Molecular formula
- C19H16N2O3
- Average molar mass
- 320.3 g/mol
- Monoisotopic mass
- 320.11609238
Names & identifiers
- Preferred name
- Methyl 2-(1-methyl-3-indolyl)-6-benzoxazolylacetate
- IUPAC
- methyl 2-[2-(1-methylindol-3-yl)-1,3-benzoxazol-6-yl]acetate
Names & synonyms
SCHEMBL2437817OJBQKTGRJXLCDJ-UHFFFAOYSA-Nmethyl 2-(1-methyl-3-indolyl)-6-benzoxazolylacetate
Database identifiers
- PubChem CID
- 58778404
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 472
Related reactions
3 records
Compound notes
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