Win-5786
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Basic information
- CAS
64046-66-8- Standard SMILES
CC(C(=O)OCCC1CCCCN1)c1ccc(-c2ccccc2)cc1- InChIKey
QDWYZUCHSFEDPR-UHFFFAOYSA-N- Molecular formula
- C22H27NO2
- Average molar mass
- 337.5 g/mol
- Monoisotopic mass
- 337.2041791
Names & identifiers
- Preferred name
- Win-5786
- IUPAC
- 2-piperidin-2-ylethyl 2-(4-phenylphenyl)propanoate
- English name
- Methyl-p-xenylacetate ester of beta-piperidinoethanol
- Molecular formula
- C22H27NO2
- Molecular weight
- 337.46
Names & synonyms
WIN 578664046-66-8Methyl-p-xenylacetate ester of beta-piperidinoethanolWin-5786ACETIC ACID, 2-(4-BIPHENYLYL)-2-METHYL-, 2-PIPERIDINOETHYL ESTERRefChem:3883932-piperidin-2-ylethyl 2-(4-phenylphenyl)propanoateDTXSID20982192DB-2175292-(Piperidin-2-yl)ethyl 2-([1,1'-biphenyl]-4-yl)propanoate2-(Biphenyl-4-yl)propionic acid 2-piperidinoethyl ester[1,1'-Biphenyl]-4-acetic acid, α-methyl-, 2-(1-piperidinyl)ethyl ester
Database identifiers
- CAS
64046-66-8- PubChem CID
- 46657
- DTXSID
DTXSID20982192
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 397
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Related reactions
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Compound notes
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