Basic information
- CAS
4544-15-4- Standard SMILES
O=C(OCC[NH+]1CCCCC1)C(O)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
ZJVKLBBPLUXEAC-UHFFFAOYSA-N- Molecular formula
- C21H26ClNO3
- Average molar mass
- 375.9 g/mol
- Monoisotopic mass
- 375.1601214
Overview
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Names & identifiers
- Preferred name
- Offterror
- IUPAC
- 2-piperidin-1-ium-1-ylethyl 2-hydroxy-2,2-diphenylacetate chloride
- English name
- Piperilate hydrochloride
- Molecular formula
- C21H25NO3.ClH
- Molecular weight
- 375.893
Names & synonyms
OffterrorPensanatePhorbicPipenateSycotrolPinate2-Piperidinoethyl benzilate hydrochloride1-Piperidineethanol benzilate hydrochloride2-(1-Piperidino)ethyl benzilate hydrochloridePiperilate HClNSC 30793UNII-07OS4SZ89Z
Show more names
Piperilate hydrochloridePipethanate hydrochloride
1-Piperidineethanol, benzilate (ester), hydrochlorideBENZILIC ACID, 2-PIPERIDINOETHYL ESTER, HYDROCHLORIDEBenzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 2-(1-piperidinyl)ethyl ester, hydrochlorideNS00125205
Database identifiers
- CAS
4544-15-4- PubChem CID
- 20673
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 389
Physicochemical properties
- Melting point
- 170 · 170-171°
- FDA UNII
- 7 OS4SZ89Z · 07OS4SZ89Z
Chemistry & industry
Applications
UsesPiperilate (Pipethanate) hydrochloride is one of the mixtures of hetrazepine derivative PAF antagonists with anticholinergics, can be used for bronchial asthma research. Piperilate hydrochloride also causes hypotension and rescues mice poisoned by the organophosphates[1][2][3].
Suppliers2 total
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]
Additional notes
DefinitionChEBI: Pipethanate hydrochloride is a diarylmethane.
Related reactions
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Compound notes
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