Basic information
- CAS
2354-61-2- Standard SMILES
O=C(CCCN1CCN(c2ccccc2)CC1)c1ccc(F)cc1- InChIKey
QPHRVUMZLUQZGU-UHFFFAOYSA-N- Molecular formula
- C20H23FN2O
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.17944152
Names & identifiers
- Preferred name
- Butropipazone
- IUPAC
- 1-(4-fluorophenyl)-4-(4-phenylpiperazin-1-yl)butan-1-one
- English name
- 1-Butanone, 1-(4-fluorophenyl)-4-(4-phenyl-1-piperazinyl)-
- Molecular formula
- C20H23FN2O
- Molecular weight
- 326.41
Names & synonyms
ButropipazoneButropipazonGalvanisone2354-61-2Butyropipazone1-Butanone, 1-(4-fluorophenyl)-4-(4-phenyl-1-piperazinyl)-R 1892NSC 170975BUTYROPHENONE, 4'-FLUORO-4-(4-PHENYL-1-PIPERAZINYL)-4'-Fluoro-4-(1-(4-phenyl)piperazino)butyrophenoneBRN 0895232gamma-(4-Phenylpiperazino)-4-fluorobutyrophenone
Show more names
1-(4-Fluorophenyl)-4-(4-phenyl-1-piperazinyl)-1-butanone1-(4-Fluorophenyl)-4-(4-phenylpiperazin-1-Yl)butan-1-one hydrochloride
DTXSID501781225-23-02-00209 (Beilstein Handbook Reference).gamma.-(4-Phenylpiperazino)-4-fluorobutyrophenone4'-Fluoro-4-[1-(4-phenyl)piperazino]butyrophenoneRefChem:122191DTXCID801006131-Butanone, 1-(4-fluorophenyl)-4-(4-phenyl-1-piperazinyl)-(9CI)QPHRVUMZLUQZGU-UHFFFAOYSA-N
Database identifiers
- CAS
2354-61-2- PubChem CID
- 16889
- DTXSID
DTXSID50178122- ChEMBL
CHEMBL2362425、CHEMBL265274- UNII
- 47UB2NB3UD
- Nikkaji
- J42.938D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 381
Physicochemical properties
- Density
- 1.1177 · 1.1177 (estimate)
- FDA UNII
- 47 UB2NB3UD · 47UB2NB3UD
Chemistry & industry
Applications
UsesButropipazon is derived from 1-Phenylpiperazine (P336040), which was tested for its activity as a topical glaucoma agent.
Suppliers3 total
HONEST JOY HOLDINGS LIMITED[email protected]
CLEARSYNTH LABS LTD.+91-22-45045900 · [email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…