Basic information
- CAS
179756-85-5- Standard SMILES
Cn1c(=O)cnn(CCCCN2CCN(c3ncccn3)CC2)c1=O- InChIKey
NMYAHEULKSYAPP-UHFFFAOYSA-N- Molecular formula
- C16H23N7O2
- Average molar mass
- 345.4 g/mol
- Monoisotopic mass
- 345.191323
Overview
Eptapirone is a N-arylpiperazine.
Names & identifiers
- Preferred name
- Eptapirone
- IUPAC
- 4-methyl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2,4-triazine-3,5-dione
- English name
- 4-methyl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2,4-triazine-3, 5-dione
- Molecular formula
- C20H27N7O6
- Molecular weight
- 461.48
Names & synonyms
Eptapirone179756-85-5eptapironaF-114404-methyl-2-(4-(4-(pyrimidin-2-yl)piperazin-1-yl)butyl)-1,2,4-triazine-3,5(2H,4H)-dione3M824XRO8NDTXSID401708574-methyl-2-(4-(4-(pyrimidin-2-yl)piperazino)butyl)-2H,4H-1,2,4-triazin-3,5-dioneeptapironum4-Methyl-2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}-1,2,4-triazine-3,5(2H,4H)-dioneRefChem:137428DTXCID0093348
Show more names
Eptapirone fumarate4-methyl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2,4-triazine-3, 5-dione
179756-58-2F 11440Eptapirone [INN]4-methyl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2,4-triazine-3,5-dioneF114401,2,4-Triazine-3,5(2H,4H)-dione, 4-methyl-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-MFCD08690608Eptapirone (INN)
Database identifiers
- CAS
179756-85-5- PubChem CID
- 208928
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 499
Physicochemical properties
- FDA UNII
- 3 M824XRO8N · 3M824XRO8N
Chemistry & industry
Applications
UsesEptapirone (F11440) fumarate is a potent and selective 5-HT1A receptor agonist (pKi= 8.33) with marked anxiolytic and antidepressant potential[1].
Suppliers10 total
北京华美互利生物化工010-56205725 · [email protected]
南京百鑫德诺生物科技有限公司025-58849295 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
上海东苍生物科技有限公司+86-21-58447131 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
上海珀法姆医药科技有限公司+86 18721201413 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Additional notes
DefinitionChEBI: Eptapirone is a N-arylpiperazine.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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