Basic information
- Standard SMILES
Cc1cc(OCCOC2CCCCO2)ccc1C(=O)c1ccc(N)cc1Cl- InChIKey
RLKLXYVXGSRYDF-UHFFFAOYSA-N- Molecular formula
- C21H24ClNO4
- Average molar mass
- 389.9 g/mol
Names & identifiers
- Preferred name
- (4-Amino-2-chloro-phenyl)-{2-methyl-4-[2-(tetrahydro-pyran-2-yloxy)-ethoxy]-phenyl}-methanone
- IUPAC
- (4-amino-2-chlorophenyl)-[2-methyl-4-[2-(oxan-2-yloxy)ethoxy]phenyl]methanone
Names & synonyms
SCHEMBL2197670RLKLXYVXGSRYDF-UHFFFAOYSA-N(4-Amino-2-chloro-phenyl)-{2-methyl-4-[2-(tetrahydro-pyran-2-yloxy)-ethoxy]-phenyl}-methanone
Database identifiers
- PubChem CID
- 67313818
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 477
Related reactions
2 records
Compound notes
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