Basic information
- Standard SMILES
COc1cc2nccc(Oc3cc(C)c(NC(=O)OC(C)c4cccc(Cl)c4)cc3C)c2cc1OC- InChIKey
JLKSIJKLWZOGSF-UHFFFAOYSA-N- Molecular formula
- C28H27ClN2O5
- Average molar mass
- 507 g/mol
- Monoisotopic mass
- 506.1608497
Names & identifiers
- Preferred name
- 1-(3-Chlorophenyl)ethyl N-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-2,5-dimethylphenyl}carbamate
- IUPAC
- 1-(3-chlorophenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]carbamate
Names & synonyms
SCHEMBL5825589JLKSIJKLWZOGSF-UHFFFAOYSA-N1-(3-Chlorophenyl)ethyl N-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-2,5-dimethylphenyl}carbamate
Database identifiers
- PubChem CID
- 21889862
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 713
Related reactions
1 records
Compound notes
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