Basic information
- CAS
21580-07-4- Standard SMILES
COc1ccccc1N1CCN(CCC(=O)c2ccc(N3CCOCC3)cc2)CC1.Cl.Cl- InChIKey
WOJATDXXHKRDIF-UHFFFAOYSA-N- Molecular formula
- C24H33Cl2N3O3
- Average molar mass
- 482.4 g/mol
- Monoisotopic mass
- 481.1898973
Overview
structure
Names & identifiers
- Preferred name
- Methoxyphenyl piperazinyl
- IUPAC
- 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(4-morpholin-4-ylphenyl)propan-1-one;dihydrochloride
Names & synonyms
Methoxyphenyl piperazinyl6726KWW1YW21580-07-4DTXSID20175941RefChem:157096DTXCID9098432SU-17595A3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-[4-(morpholin-4-yl)phenyl]propan-1-one dihydrochlorideUNII-6726KWW1YW1-Propanone, 3-(4-(2-methoxyphenyl)-1-piperazinyl)-1-(4-(4-morpholinyl)phenyl)-, 2HClPropiophenone, 3-(4-(o-methoxyphenyl)-1-piperazinyl)-4'-morpholino-, dihydrochlorideQ27264056
Show more names
3-[4-(o-Methoxyphenyl)-1-piperazinyl]-p-morpholinopropiophenone dihydrochloride1-Propanone, 3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-[4-(4-morpholinyl)phenyl]-, dihydrochloride1-Propanone, 3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-[4-(4-morpholinyl)phenyl]-, hydrochloride (1:2)3-[4-(2-Methoxyphenyl)-1-piperazinyl]-1-[4-(4-morpholinyl)phenyl]-1-propanone dihydrochloride3-[4-(2-Methoxyphenyl)piperazin-1-yl]-1-[4-(morpholin-4-yl)phenyl]propan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
21580-07-4- PubChem CID
- 88952
- DTXSID
DTXSID20175941- UNII
- 6726KWW1YW
Properties
Computed structural properties
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 524
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…