Basic information
- Standard SMILES
Cc1cnc(N2CCN(C(=O)c3ccc(Cl)cc3N3CCCC3=O)CC2)c(C)c1- InChIKey
UAKDIUIVOZRFTK-UHFFFAOYSA-N- Molecular formula
- C22H25ClN4O2
- Average molar mass
- 412.9 g/mol
Names & identifiers
- Preferred name
- 1-{5-Chloro-2-[4-(3,5-dimethylpyridin-2-yl)piperazine-1-carbonyl]phenyl}pyrrolidin-2-one
- IUPAC
- 1-[5-chloro-2-[4-(3,5-dimethyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
Names & synonyms
SCHEMBL2366353UAKDIUIVOZRFTK-UHFFFAOYSA-N1-{5-chloro-2-[4-(3,5-dimethylpyridin-2-yl)piperazine-1-carbonyl]phenyl}pyrrolidin-2-one
Database identifiers
- PubChem CID
- 58484698
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 610
Related reactions
8 records
Compound notes
Loading…