4-(4-(4-Chlorophenyl)-4-hydroxy-1-piperidinyl)-1-(4-(dimethylamino)phenyl)-1-butanone
Basic information
- CAS
24671-21-4- Standard SMILES
CN(C)c1ccc(C(=O)CCCN2CCC(O)(c3ccc(Cl)cc3)CC2)cc1- InChIKey
KNIHPCIOQUKGMN-UHFFFAOYSA-N- Molecular formula
- C23H29ClN2O2
- Average molar mass
- 400.9 g/mol
- Monoisotopic mass
- 400.1917559
Names & identifiers
- Preferred name
- 4-(4-(4-Chlorophenyl)-4-hydroxy-1-piperidinyl)-1-(4-(dimethylamino)phenyl)-1-butanone
- IUPAC
- 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-[4-(dimethylamino)phenyl]butan-1-one
Names & synonyms
24671-21-4S83CV95YBXNSC-1704764-(4-(4-Chlorophenyl)-4-hydroxy-1-piperidinyl)-1-(4-(dimethylamino)phenyl)-1-butanone4-[4-(4-Chlorophenyl)-4-hydroxy-1-piperidinyl]-1-[4-(dimethylamino)phenyl]-1-butanoneRefChem:1069923NSC 170476NSC1704764-(4-(p-Chlorophenyl)-4-hydroxypiperidino)-4'-(dimethylamino)butyrophenone4-(Dimethylamino)phenyl-3-(4-(4-chlorophenyl)-4-hydroxypiperidino)-propyl ketone4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-[4-(dimethylamino)phenyl]butan-1-oneBUTYROPHENONE, 4-(4-(p-CHLOROPHENYL)-4-HYDROXYPIPERIDINO)-4'-(DIMETHYLAMINO)-
Show more names
BRN 15072364-(4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl)-1-(4-(dimethylamino)phenyl)butan-1-oneUNII-S83CV95YBXDTXSID601794081-Butanone, 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-1-[4-(dimethylamino)phenyl]-4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-1-(4-dimethylaminophenyl)butan-1-one
Database identifiers
- CAS
24671-21-4- PubChem CID
- 32589
- DTXSID
DTXSID60179408- UNII
- S83CV95YBX
- Nikkaji
- J67.444C
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 489
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Compound notes
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