(S)-paliperidone
TL;DR: (S)-paliperidone (CAS 1020719-55-4) is a chemical compound with molecular formula C23H27FN4O3 and molecular weight 426.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9S)-3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
Also Known As: (S)-paliperidone, Paliperidone, (S)-9-Hydroxy Risperidone, Invega, Invega Sustenna
| Molecular Formula | C23H27FN4O3 |
|---|---|
| Molecular Weight | 426.21 g/mol |
| LogP | 3.08132 |
| Topological Polar Surface Area | 84.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.20673 |
| Heavy Atoms | 31 |
| Complexity | 1163.5734 |
Chemical Identifiers
| CAS Number | 1020719-55-4 |
|---|---|
| SMILES | CC1=C(C(=O)N2CCC[C@@H](C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F |
Product Overview
(S)-paliperidone (CAS 1020719-55-4), with molecular formula C23H27FN4O3 and molecular weight 426.21 g/mol. IUPAC: (9S)-3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one.
Chemical Property Profile of (S)-paliperidone
Property Insights of (S)-paliperidone
The XLogP value of 3.08132 indicates that (S)-paliperidone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.39 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-paliperidone. Following Lipinski's Rule of Five, (S)-paliperidone has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-paliperidone?
The CAS number of (S)-paliperidone is 1020719-55-4.
What is the molecular formula of (S)-paliperidone?
The molecular formula of (S)-paliperidone is C23H27FN4O3.
What is the molecular weight of (S)-paliperidone?
The molecular weight of (S)-paliperidone is 426.21 g/mol.
Where can I buy (S)-paliperidone?
You can request a quote for (S)-paliperidone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-paliperidone?
Yes, KEHONG BIO provides custom synthesis services for (S)-paliperidone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.