Basic information
- Standard SMILES
COc1cc2nccc(Oc3ccc(NC(=O)OC(C)c4ccc(C)cc4)cc3)c2cc1OC- InChIKey
NAECELDIABAPGH-UHFFFAOYSA-N- Molecular formula
- C27H26N2O5
- Average molar mass
- 458.5 g/mol
Names & identifiers
- Preferred name
- 1-(4-Methylphenyl)ethyl N-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}carbamate
- IUPAC
- 1-(4-methylphenyl)ethyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate
Names & synonyms
SCHEMBL5824812NAECELDIABAPGH-UHFFFAOYSA-N1-(4-Methylphenyl)ethyl N-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}carbamate
Database identifiers
- PubChem CID
- 21889992
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 633
Related reactions
1 records
Compound notes
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