Basic information
- CAS
20326-12-9- Standard SMILES
Cc1cc(CCN2CCN(c3cccc(Cl)c3)CC2)n[nH]1- InChIKey
DOTIMEKVTCOGED-UHFFFAOYSA-N- Molecular formula
- C16H21ClN4
- Average molar mass
- 304.82 g/mol
- Monoisotopic mass
- 304.1454744
Overview
Mepiprazole is a member of piperazines.
Names & identifiers
- Preferred name
- 1-(3-chlorophenyl)-4-(2-(5-methyl-1H-pyrazol-3-yl)ethyl)piperazine
- IUPAC
- 1-(3-chlorophenyl)-4-[2-(5-methyl-1H-pyrazol-3-yl)ethyl]piperazine
- English name
- Mepiprazole
- Molecular formula
- C16H21ClN4
- Molecular weight
- 304.82
Names & synonyms
Mepiprazole20326-12-9MepiprazolMepiprazolum1-(3-chlorophenyl)-4-[2-(5-methyl-1H-pyrazol-3-yl)ethyl]piperazineEMD-16923977BAL0NR7DTXSID301742231-(3-Chlorophenyl)-4-(2-(5-methyl-1H-pyrazol-3-yl)ethyl)piperazineRefChem:156513DTXCID60967141-(m-Chlorophenyl)-4-(2-(5-methylpyrazol-3-yl)ethyl)piperazine
Show more names
H-4007PsigodalPiperazine, 1-(3-chlorophenyl)-4-[2-(5-methyl-1H-pyrazol-3-yl)ethyl]-
Mepiprazole [INN:BAN]Mepiprazol [INN-Spanish]Mepiprazolum [INN-Latin]UNII-977BAL0NR7EMD 16923MEPIPRAZOLE [MI]MEPIPRAZOLE [INN]SCHEMBL355534
Database identifiers
- CAS
20326-12-9- PubChem CID
- 71897
- DTXSID
DTXSID30174223- ChEMBL
CHEMBL2106537- ChEBI
CHEBI:134701- UNII
- 977BAL0NR7
- Nikkaji
- J10.949E
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 35.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 319
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Melting point
- 106 ° · 106°
- Boiling point
- 495.3 · 495.3±45.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- pka
- 15.1 · 15.10±0.10(Predicted)
- FDA UNII
- 977 BAL0NR7 · 977BAL0NR7
Chemistry & industry
Suppliers2 total
Xuzhou B&C Chemical Technology Co., Ltd+86-400-0516-021 +86-15190678838 · [email protected]
徐州博康化学科技股份有限公司051686297676 · [email protected]
Additional notes
DefinitionChEBI: Mepiprazole is a member of piperazines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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