Win 52084
TL;DR: Win 52084 (CAS 5461-01-8) is a chemical compound with molecular formula C21H28N2O3 and molecular weight 356.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-[7-[4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy]heptyl]-1,2-oxazole
Also Known As: WIN I(S), Win 52084, WIN52084(S), WIN 52084 (S), WIN I(S); WIN 52084 (S)
| Molecular Formula | C21H28N2O3 |
|---|---|
| Molecular Weight | 356.21 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 56.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 356.21 |
| Heavy Atoms | 26 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 5461-01-8 |
|---|---|
| SMILES | C[C@H]1COC(=N1)C2=CC=C(C=C2)OCCCCCCCC3=CC(=NO3)C |
| InChIKey | NEAZMARKCJKUMF-KRWDZBQOSA-N |
Product Overview
Win 52084 (CAS 5461-01-8), with molecular formula C21H28N2O3 and molecular weight 356.21 g/mol. IUPAC: 3-methyl-5-[7-[4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy]heptyl]-1,2-oxazole.
Chemical Property Profile of Win 52084
Property Insights of Win 52084
The XLogP value of 4.8 indicates that Win 52084 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.9 Ų, Win 52084 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Win 52084 has 0 hydrogen bond donor(s) and 5 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 Win 52084?
The CAS number of Win 52084 is 5461-01-8.
What is the molecular formula of Win 52084?
The molecular formula of Win 52084 is C21H28N2O3.
What is the molecular weight of Win 52084?
The molecular weight of Win 52084 is 356.21 g/mol.
Where can I buy Win 52084?
You can request a quote for Win 52084 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Win 52084?
Yes, KEHONG BIO provides custom synthesis services for Win 52084 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.