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Chemistry

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Also known as: (s)-cloperastine, 132301-89-4, 1-[2-[(s)-(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine, 99v54164fc, Unii-99v54164fc, L-cloperastine
Molecular Formula
C20H24ClNO
Molecular Weight
329.9  g/mol
InChI Key
FLNXBVJLPJNOSI-FQEVSTJZSA-N
FDA UNII
99V54164FC

Levocloperastine
1 2D Structure

Levocloperastine

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-[2-[(S)-(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine
2.1.2 InChI
InChI=1S/C20H24ClNO/c21-19-11-9-18(10-12-19)20(17-7-3-1-4-8-17)23-16-15-22-13-5-2-6-14-22/h1,3-4,7-12,20H,2,5-6,13-16H2/t20-/m0/s1
2.1.3 InChI Key
FLNXBVJLPJNOSI-FQEVSTJZSA-N
2.1.4 Canonical SMILES
C1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl
2.1.5 Isomeric SMILES
C1CCN(CC1)CCO[C@@H](C2=CC=CC=C2)C3=CC=C(C=C3)Cl
2.2 Other Identifiers
2.2.1 UNII
99V54164FC
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. (s)-cloperastine

2. 132301-89-4

3. 1-[2-[(s)-(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine

4. 99v54164fc

5. Unii-99v54164fc

6. L-cloperastine

7. Ncgc00016711-01

8. Cas-14984-68-0

9. Chembl1516068

10. Zinc57251

11. Levocloperastine [who-dd]

12. Q27272245

13. Piperidine, 1-(2-((s)-(4-chlorophenyl)phenylmethoxy)ethyl)-

2.4 Create Date
2005-07-07
3 Chemical and Physical Properties
Molecular Weight 329.9 g/mol
Molecular Formula C20H24ClNO
XLogP34.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass329.1546421 g/mol
Monoisotopic Mass329.1546421 g/mol
Topological Polar Surface Area12.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity318
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

API Reference Price

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20-May-2021
27-Jul-2024
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