Acetophenone, 2'-((2-hydroxy-3-(4-(o-methoxyphenyl)piperazinyl))propoxy)-, dihydrochloride

HCID 46192

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Basic information

CAS: 63990-78-3
Standard SMILES: COc1ccccc1N1CCN(CC(O)COc2ccccc2C(C)=O)CC1.Cl.Cl
InChIKey: BXXVTBZNDMLJMK-UHFFFAOYSA-N
Molecular formula: C22H30Cl2N2O4
Average molar mass: 457.4 g/mol
Monoisotopic mass: 456.1582628

Names & identifiers

Preferred name: Acetophenone, 2'-((2-hydroxy-3-(4-(o-methoxyphenyl)piperazinyl))propoxy)-, dihydrochloride
IUPAC: 1-[2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]ethanone;dihydrochloride

Names & synonyms

Acetophenone, 2'-((2-hydroxy-3-(4-(o-methoxyphenyl)piperazinyl))propoxy)-, dihydrochloride63990-78-32'-((2-Hydroxy-3-(4-(o-methoxyphenyl)piperazinyl))propoxy)acetophenone dihydrochlorideRefChem:3168721-[2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]ethanone;dihydrochloride1-(2-(2-hydroxy-3-(4-(2-methoxyphenyl)piperazin-1-yl)propoxy)phenyl)ethanone dihydrochloride1-(2-{2-HYDROXY-3-[4-(2-METHOXYPHENYL)PIPERAZIN-1-YL]PROPOXY}PHENYL)ETHANONE DIHYDROCHLORIDE1-[2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]ethanone dihydrochlorideDTXSID20981786F1681-0036AKOS026679341ST108435

Show more names

VU0494432-1SR-01000014183SR-01000014183-11-(2-{2-Hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy}phenyl)ethan-1-one--hydrogen chloride (1/2)

Database identifiers

CAS: 63990-78-3
PubChem CID: 46192
DTXSID: DTXSID20981786

Properties

Computed structural properties

Topological polar surface area: 62.2 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 6
Rotatable bonds: 8
Heavy atoms: 30
Formal charge: 0
Complexity: 481

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