F3394-0836
TL;DR: F3394-0836 (CAS 727689-04-5) is a chemical compound with molecular formula C22H26N4OS and molecular weight 394.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-methoxyphenyl)piperazin-1-yl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraene
Also Known As: F3394-0836, 3-[4-(4-methoxyphenyl)piperazin-1-yl]-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7),3,5-tetraene, 3-[4-(4-methoxyphenyl)piperazin-1-yl]-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2,4,6-tetraene, 3-[4-(4-methoxyphenyl)piperazin-1-yl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraene, 3-[4-(p-methoxyphenyl)-1-piperazinyl]-8-thia-4,6-diazatricyclo[7.5.0.0(2),]tetradeca-1(9),2(7),3,5-tetraene
| Molecular Formula | C22H26N4OS |
|---|---|
| Molecular Weight | 394.18 g/mol |
| LogP | 4.2954 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.18274 |
| Heavy Atoms | 28 |
| Complexity | 960.5773 |
Chemical Identifiers
| CAS Number | 727689-04-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)C3=C4C5=C(CCCCC5)SC4=NC=N3 |
Product Overview
F3394-0836 (CAS 727689-04-5), with molecular formula C22H26N4OS and molecular weight 394.18 g/mol. IUPAC: 3-[4-(4-methoxyphenyl)piperazin-1-yl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraene.
Chemical Property Profile of F3394-0836
Property Insights of F3394-0836
The XLogP value of 4.2954 indicates that F3394-0836 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.49 Ų, F3394-0836 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F3394-0836 has 0 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 F3394-0836?
The CAS number of F3394-0836 is 727689-04-5.
What is the molecular formula of F3394-0836?
The molecular formula of F3394-0836 is C22H26N4OS.
What is the molecular weight of F3394-0836?
The molecular weight of F3394-0836 is 394.18 g/mol.
Where can I buy F3394-0836?
You can request a quote for F3394-0836 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0836?
Yes, KEHONG BIO provides custom synthesis services for F3394-0836 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.