Basic information
- Standard SMILES
COCN1C(=O)CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc21- InChIKey
IHBLHAMQMZQEIG-UHFFFAOYSA-N- Molecular formula
- C25H31Cl2N3O3
- Average molar mass
- 492.4 g/mol
Names & identifiers
- Preferred name
- 7-(4-(4-(2,3-dichlorophenyl)piperazin-1-yl)butoxy)-1-(methoxymethyl)-3,4-dihydroquinolin-2(1H)-one
- IUPAC
- 7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-1-(methoxymethyl)-3,4-dihydroquinolin-2-one
Names & synonyms
SCHEMBL1042920IHBLHAMQMZQEIG-UHFFFAOYSA-N7-(4-(4-(2,3-dichlorophenyl)piperazin-1-yl)butoxy)-1-(methoxymethyl)-3,4-dihydroquinolin-2(1H)-one
Database identifiers
- PubChem CID
- 58096748
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 620
Related reactions
1 records
Compound notes
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