Ethanone, 1-(4-(3-chlorophenyl)-1-(3-(4-methyl-1-piperazinyl)propyl)-4-piperidinyl)-, trihydrochloride
Basic information
- CAS
62270-81-9- Standard SMILES
CC(=O)C1(c2cccc(Cl)c2)CCN(CCCN2CCN(C)CC2)CC1.Cl.Cl.Cl- InChIKey
XENTZWSYPZRHPR-UHFFFAOYSA-N- Molecular formula
- C21H35Cl4N3O
- Average molar mass
- 487.3 g/mol
- Monoisotopic mass
- 485.153424
Names & identifiers
- Preferred name
- Ethanone, 1-(4-(3-chlorophenyl)-1-(3-(4-methyl-1-piperazinyl)propyl)-4-piperidinyl)-, trihydrochloride
- IUPAC
- 1-[4-(3-chlorophenyl)-1-[3-(4-methylpiperazin-1-yl)propyl]piperidin-4-yl]ethanone;trihydrochloride
Names & synonyms
62270-81-9Ethanone, 1-(4-(3-chlorophenyl)-1-(3-(4-methyl-1-piperazinyl)propyl)-4-piperidinyl)-, trihydrochlorideDTXSID50211341RefChem:341171DTXCID501338321-{4-(3-Chlorophenyl)-1-[3-(4-methylpiperazin-1-yl)propyl]piperidin-4-yl}ethan-1-one--hydrogen chloride (1/3)
Database identifiers
- CAS
62270-81-9- PubChem CID
- 43985
- DTXSID
DTXSID50211341
Properties
Computed structural properties
- Topological polar surface area
- 26.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 456
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…