Basic information
- CAS
87051-46-5- Standard SMILES
O=C(c1ccc(F)cc1)C1CCN(CCCCn2c(=O)[nH]c3ccccc3c2=O)CC1- InChIKey
MLDQSYUQSLUEPG-UHFFFAOYSA-N- Molecular formula
- C24H26FN3O3
- Average molar mass
- 423.5 g/mol
- Monoisotopic mass
- 423.19581986
Overview
Butanserin is a small molecule drug. The usage of the INN stem '-anserin' in the name indicates that Butanserin is a serotonin receptor antagonist. Butanserin has a monoisotopic molecular weight of 423.2 Da.
Names & identifiers
- Preferred name
- 3-(4-(4-(4-Fluorobenzoyl)-1-piperidinyl)butyl)-2,4(1H,3H)-quinazolinedione
- IUPAC
- 3-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-1H-quinazoline-2,4-dione
- English name
- Butanserin
- Molecular formula
- C24H26FN3O3
- Molecular weight
- 423.4799432
Names & synonyms
Butanserin87051-46-5ButanserinaButanserineButanserinum4I933V848GDTXSID40236109RefChem:910980DTXCID90158600R-533933-(4-(4-(4-Fluorobenzoyl)-1-piperidinyl)butyl)-2,4(1H,3H)-quinazolinedioneButanserin [INN]
Show more names
R53393R 533933-[4-[4-(4-Fluorobenzoyl)piperidin-1-yl]butyl]quinazoline-2,4(1H,3H)-dione
3-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-1H-quinazoline-2,4-dione3-(4-(4-(p-Fluorobenzoyl)piperidino)butyl)-2,4(1H,3H)quinazolinedioneButanserine [French]Butanserinum [Latin]Butanserina [Spanish]UNII-4I933V848GSCHEMBL875652orb1702471
Database identifiers
- CAS
87051-46-5- PubChem CID
- 65652
- DTXSID
DTXSID40236109- ChEMBL
CHEMBL1742433- UNII
- 4I933V848G
- Nikkaji
- J23.317J
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 656
Physicochemical properties
- FDA UNII
- 4 I933V848G · 4I933V848G
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationDrugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS.
Applications
UsesButanserin is used in receptor bnding, and in other pharmalogical activities. Also an α1- and α2-adrenoceptor antagonistic
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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