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2D Structure
Also known as: 501373-88-2, (s)-hydroxy iloperidone, Unii-7sv1zog031, 7sv1zog031, P-88-8991, (-)-, (s)-1-(4-{3-[4-(6-fluoro-benzo[d]isoxazol-3-yl)-piperidin-1-yl]-propoxy}-3-methoxy-phenyl)-ethanol
Molecular Formula
C24H29FN2O4
Molecular Weight
428.5  g/mol
InChI Key
SBKZGLWZGZQVHA-INIZCTEOSA-N
FDA UNII
7SV1ZOG031

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1S)-1-[4-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-3-methoxyphenyl]ethanol
2.1.2 InChI
InChI=1S/C24H29FN2O4/c1-16(28)18-4-7-21(23(14-18)29-2)30-13-3-10-27-11-8-17(9-12-27)24-20-6-5-19(25)15-22(20)31-26-24/h4-7,14-17,28H,3,8-13H2,1-2H3/t16-/m0/s1
2.1.3 InChI Key
SBKZGLWZGZQVHA-INIZCTEOSA-N
2.2 Other Identifiers
2.2.1 UNII
7SV1ZOG031
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 501373-88-2

2. (s)-hydroxy Iloperidone

3. Unii-7sv1zog031

4. 7sv1zog031

5. P-88-8991, (-)-

6. (s)-1-(4-{3-[4-(6-fluoro-benzo[d]isoxazol-3-yl)-piperidin-1-yl]-propoxy}-3-methoxy-phenyl)-ethanol

7. Milsaperidone (usan)

8. Milsaperidone [usan]

9. (1s)-1-[4-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-3-methoxyphenyl]ethanol

10. Milsaperidone

11. Benzenemethanol, 4-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]propoxy]-3-methoxy-alpha-methyl-, (alphas)-

12. Milsaperidone [inn]

13. Schembl1566323

14. Vhx896

15. Vhx-896

16. Sbkzglwzgzqvha-inizcteosa-n

17. D13099

18. (-)-p-88-8991

19. Q27268802

20. (

21. As)-4-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]propoxy]-3-methoxy-

22. A-methylbenzenemethanol

23. (alphas)-4-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]propoxy]-3-methoxy-alpha-methylbenzenemethanol

24. (s)-1-(4-(3-(4-(6-fluorobenzo[d]isoxazol-3-yl)piperidin-1-yl)propoxy)-3-methoxyphenyl)ethan-1-ol

25. (s)-1-[4-{3-[4-(6-fluoro-benzo(d)isoxazol-3-yl)-piperidin-1-yl]-propoxy}-3-methoxv-phenyl]-ethanol

26. (s)-1-[4-{3-[4-(6-fluoro-benzo(d)isoxazol-3-yl)-piperidin-1-yl]-propoxy}-3-methoxy-phenyl]ethanol

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 428.5 g/mol
Molecular Formula C24H29FN2O4
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area68
Heavy Atom Count31
Formal Charge0
Complexity548
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1