6-chloro-5-[4-(5-oxomorpholin-2-yl)phenyl]-1H-indole-3-carboxylic acid
Basic information
- Standard SMILES
O=C1COC(c2ccc(-c3cc4c(C(=O)O)c[nH]c4cc3Cl)cc2)CN1- InChIKey
DCOGTOCHRMONGS-UHFFFAOYSA-N- Molecular formula
- C19H15ClN2O4
- Average molar mass
- 370.8 g/mol
- Monoisotopic mass
- 370.0720347
Names & identifiers
- Preferred name
- 6-chloro-5-[4-(5-oxomorpholin-2-yl)phenyl]-1H-indole-3-carboxylic acid
- IUPAC
- 6-chloro-5-[4-(5-oxomorpholin-2-yl)phenyl]-1H-indole-3-carboxylic acid
Names & synonyms
SCHEMBL15301826DCOGTOCHRMONGS-UHFFFAOYSA-NDB-1971896-Chloro-5-[4-(5-oxo-2-morpholinyl)phenyl]-1h-indole-3-carboxylic acid6-chloro-5-[4-(5-oxomorpholin-2-yl)phenyl]-1H-indole-3-carboxylic acid1467058-77-0
Database identifiers
- PubChem CID
- 86698751
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 91.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 552
Related reactions
2 records
Compound notes
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