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FINISHED DOSAGE FORMULATIONS

1 FDF Dossiers, 1 South Africa

1 FDF Dossiers
1 South Africa

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Chemistry

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Also known as: Dipipanone hcl, Fenpidon, Hoechst 10805, 75783-06-1, Pipadone, Hoechst-10805

Molecular Formula

C₂₄H₃₂ClNO

Molecular Weight

386.0 g/mol

InChI Key

DTXPDSQEMZRBBG-UHFFFAOYSA-N

FDA UNII

8VY00AJ0RL

1 2D Structure

Dipipanone Hydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4,4-diphenyl-6-piperidin-1-ylheptan-3-one;hydrochloride

2.1.2 InChI

InChI=1S/C24H31NO.ClH/c1-3-23(26)24(21-13-7-4-8-14-21,22-15-9-5-10-16-22)19-20(2)25-17-11-6-12-18-25;/h4-5,7-10,13-16,20H,3,6,11-12,17-19H2,1-2H3;1H

2.1.3 InChI Key

DTXPDSQEMZRBBG-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCC(=O)C(CC(C)N1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3.Cl

2.2 Other Identifiers

2.2.1 UNII

8VY00AJ0RL

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 4,4-diphenyl-6-piperidino-3-heptanone

2. Dipipanone

3. Dipipanone Hydrochloride, (+-)-isomer

2.3.2 Depositor-Supplied Synonyms

1. Dipipanone Hcl

2. Fenpidon

3. Hoechst 10805

4. 75783-06-1

5. Pipadone

6. Hoechst-10805

7. 4,4-diphenyl-6-piperidino-3-heptanone Hydrochloride

8. 378c48

9. 8vy00aj0rl

10. 3-heptanone, 4,4-diphenyl-6-(1-piperidinyl)-, Hydrochloride

11. 856-87-1

12. Schembl392119

13. Chembl2107606

14. Dtxsid50997178

15. Dipipanone Hydrochloride [mi]

16. (+/-)-dipipanone Hydrochloride

17. Dipipanone Hydrochloride [mart.]

18. 856-87-1 (hcl)

19. Dipipanone Hydrochloride [who-dd]

20. Dipipanone Hydrochloride, (+/-)-

21. Q27271098

22. 4,4-diphenyl-6-piperidin-1-ylheptan-3-one;hydrochloride

23. 4,4-diphenyl-6-(piperidin-1-yl)heptan-3-one Hydrochloride

24. 4,4-diphenyl-6-(piperidin-1-yl)heptan-3-one--hydrogen Chloride (1/1)

25. 3-heptanone, 4,4-diphenyl-6-(1-piperidinyl)-, Hydrochloride (1:1)

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₂₄H₃₂ClNO
Molecular Weight	386.0 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	385.2172423 g/mol
Monoisotopic Mass	385.2172423 g/mol
Topological Polar Surface Area	20.3 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	410
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2