PR 969566
TL;DR: PR 969566 (CAS 113944-46-0) is a chemical compound with molecular formula C22H24ClN3OS and molecular weight 413.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5R)-3-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1,2-oxazolidine
Also Known As: gp120 Fragment 254-274, PR 969566, PR 969-566, PR-969-566, 2-imidazol-1-yl-N-methyl-1-phenylethanimine oxide
| Molecular Formula | C22H24ClN3OS |
|---|---|
| Molecular Weight | 413.13 g/mol |
| LogP | 5.16842 |
| Topological Polar Surface Area | 30.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.13287 |
| Heavy Atoms | 28 |
| Complexity | 898.546 |
Chemical Identifiers
| CAS Number | 113944-46-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC[C@H]2C[C@](N(O2)C)(CN3C=CN=C3)C4=CC=C(C=C4)Cl |
Product Overview
PR 969566 (CAS 113944-46-0), with molecular formula C22H24ClN3OS and molecular weight 413.13 g/mol. IUPAC: (3R,5R)-3-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1,2-oxazolidine.
Chemical Property Profile of PR 969566
Property Insights of PR 969566
The XLogP value of 5.16842 indicates that PR 969566 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.29 Ų, PR 969566 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, PR 969566 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of PR 969566?
The CAS number of PR 969566 is 113944-46-0.
What is the molecular formula of PR 969566?
The molecular formula of PR 969566 is C22H24ClN3OS.
What is the molecular weight of PR 969566?
The molecular weight of PR 969566 is 413.13 g/mol.
Where can I buy PR 969566?
You can request a quote for PR 969566 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PR 969566?
Yes, KEHONG BIO provides custom synthesis services for PR 969566 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.