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Mobenzoxamine

HCID 68855
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Basic information

CAS
65329-79-5
Standard SMILES
COc1ccc(C(OCCN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c2ccccc2)cc1
InChIKey
DFNYDADZMXPPLY-UHFFFAOYSA-N
Molecular formula
C30H35FN2O3
Average molar mass
490.6 g/mol
Monoisotopic mass
490.26317114

Names & identifiers

Preferred name
Mobenzoxamine
IUPAC
1-(4-fluorophenyl)-4-[4-[2-[(4-methoxyphenyl)-phenylmethoxy]ethyl]piperazin-1-yl]butan-1-one
English name
Mobenzoxamine
Molecular formula
C30H35FN2O3
Molecular weight
490.61

Names & synonyms

Mobenzoxamine65329-79-5MobenzoxaminaMobenzoxaminumPH0033A74X4'-Fluoro-4-(4-(2-((p-methoxy-alpha-phenylbenzyl)oxy)ethyl)-1-piperazinyl)butyrophenoneDTXSID60867136RefChem:159280DTXCID50815343Mobenzoxamine [INN]1-(4-Fluorophenyl)-4-(4-(2-((4-methoxyphenyl)(phenyl)methoxy)ethyl)piperazin-1-yl)butan-1-one1-(4-fluorophenyl)-4-[4-[2-[(4-methoxyphenyl)-phenylmethoxy]ethyl]piperazin-1-yl]butan-1-one
Show more names
4'-Fluoro-γ-[4-[2-[(p-methoxy-α-phenylbenzyl)oxy]ethyl]-1-piperazinyl]butyrophenone1-(4-Fluorophenyl)-4-[4-[2-[(4-methoxyphenyl)phenylmethoxy]ethyl]-1-piperazinyl]-1-butanone1-Butanone, 1-(4-fluorophenyl)-4-[4-[2-[(4-methoxyphenyl)phenylmethoxy]ethyl]-1-piperazinyl]-
1-(4-fluorophenyl)-4-(4-{2-[(4-methoxyphenyl)(phenyl)methoxy]ethyl}piperazin-1-yl)butan-1-oneMobenzoxaminum [INN-Latin]Mobenzoxamina [INN-Spanish]UNII-PH0033A74XS 458SCHEMBL2111666CHEMBL21047034'-Fluor-4-(4-(2-(4-methoxy-alpha-phenylbenzyloxy)ethyl)-1-piperazinyl)butyrophenon

Database identifiers

CAS
65329-79-5
PubChem CID
68855
DTXSID
DTXSID60867136
ChEMBL
CHEMBL2104703
UNII
PH0033A74X
Nikkaji
J19.970B

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
42 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
12
Heavy atoms
36
Formal charge
0
Complexity
620

Physicochemical properties

FDA UNII
33 A74X · PH0033A74X

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