Basic information
- Standard SMILES
CCOC(=O)c1c(-c2ccccc2C(C)C)c2cc(O)ccc2n1CCCOc1cccc2ccccc12- InChIKey
SGNHYVAEAHOVKY-UHFFFAOYSA-N- Molecular formula
- C33H33NO4
- Average molar mass
- 507.6 g/mol
- Monoisotopic mass
- 507.24095853
Names & identifiers
- Preferred name
- Ethyl 5-hydroxy-3-(2-isopropylphenyl)-1-(3-(naphthalen-1-yloxy)propyl)-1h-indole-2-carboxylate
- IUPAC
- ethyl 5-hydroxy-1-(3-naphthalen-1-yloxypropyl)-3-(2-propan-2-ylphenyl)indole-2-carboxylate
Names & synonyms
SCHEMBL2207188SGNHYVAEAHOVKY-UHFFFAOYSA-Nethyl 5-hydroxy-3-(2-isopropylphenyl)-1-(3-(naphthalen-1-yloxy)propyl)-1h-indole-2-carboxylate
Database identifiers
- PubChem CID
- 67316919
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 757
Related reactions
4 records
Compound notes
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