Basic information
- Standard SMILES
CCCCn1ccc2c(-c3ncco3)cc(C(=O)O)cc21- InChIKey
VUVRBTDRCVLBPW-UHFFFAOYSA-N- Molecular formula
- C16H16N2O3
- Average molar mass
- 284.31 g/mol
Names & identifiers
- Preferred name
- 1-butyl-4-(1,3-oxazol-2-yl)-1H-indole-6-carboxylic acid
- IUPAC
- 1-butyl-4-(1,3-oxazol-2-yl)indole-6-carboxylic acid
Names & synonyms
SCHEMBL3353968VUVRBTDRCVLBPW-UHFFFAOYSA-N1-butyl-4-(1,3-oxazol-2-yl)-1H-indole-6-carboxylic acid
Database identifiers
- PubChem CID
- 21085169
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 377
Related reactions
5 records
Compound notes
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