F3394-1295
TL;DR: F3394-1295 (CAS 690643-75-5) is a chemical compound with molecular formula C20H18N2O3S2 and molecular weight 398.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-2-[(10-ethyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]ethanone
Also Known As: F3394-1295, 1-(2H-1,3-benzodioxol-5-yl)-2-({10-ethyl-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9,11-tetraen-12-yl}sulfanyl)ethan-1-one, 1-(1,3-benzodioxol-5-yl)-2-[(10-ethyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]ethanone, 1-(2H-1,3-benzodioxol-5-yl)-2-{10-ethyl-7-thia-9,11-diazatricyclo[6.4.0.0(2),]dodeca-1(8),2(6),9,11-tetraen-12-ylthio}-1-ethanone, 1-(benzo[d][1,3]dioxol-5-yl)-2-((2-ethyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)ethanone
| Molecular Formula | C20H18N2O3S2 |
|---|---|
| Molecular Weight | 398.08 g/mol |
| LogP | 4.4461 |
| Topological Polar Surface Area | 61.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.0759 |
| Heavy Atoms | 27 |
| Complexity | 1061.0518 |
Chemical Identifiers
| CAS Number | 690643-75-5 |
|---|---|
| SMILES | CCC1=NC2=C(C3=C(S2)CCC3)C(=N1)SCC(=O)C4=CC5=C(C=C4)OCO5 |
Product Overview
F3394-1295 (CAS 690643-75-5), with molecular formula C20H18N2O3S2 and molecular weight 398.08 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-2-[(10-ethyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]ethanone.
Chemical Property Profile of F3394-1295
Property Insights of F3394-1295
The XLogP value of 4.4461 indicates that F3394-1295 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.31 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-1295. Following Lipinski's Rule of Five, F3394-1295 has 0 hydrogen bond donor(s) and 7 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 F3394-1295?
The CAS number of F3394-1295 is 690643-75-5.
What is the molecular formula of F3394-1295?
The molecular formula of F3394-1295 is C20H18N2O3S2.
What is the molecular weight of F3394-1295?
The molecular weight of F3394-1295 is 398.08 g/mol.
Where can I buy F3394-1295?
You can request a quote for F3394-1295 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-1295?
Yes, KEHONG BIO provides custom synthesis services for F3394-1295 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.