F3394-1411
TL;DR: F3394-1411 (CAS 690642-54-7) is a chemical compound with molecular formula C19H17ClN2OS2 and molecular weight 388.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-(8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5-tetraen-3-ylsulfanyl)ethanone
Also Known As: F3394-1411, 1-(4-chlorophenyl)-2-((6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)ethanone, 1-(4-chlorophenyl)-2-{8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7),3,5-tetraen-3-ylsulfanyl}ethan-1-one, 1-(4-chlorophenyl)-2-(8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5-tetraen-3-ylsulfanyl)ethanone, 1-(p-chlorophenyl)-2-{8-thia-4,6-diazatricyclo[7.5.0.0(2),]tetradeca-1(9),2(7),3,5-tetraen-3-ylthio}-1-ethanone
| Molecular Formula | C19H17ClN2OS2 |
|---|---|
| Molecular Weight | 388.05 g/mol |
| LogP | 5.5886 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.0471 |
| Heavy Atoms | 25 |
| Complexity | 921.06885 |
Chemical Identifiers
| CAS Number | 690642-54-7 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC3=C2C(=NC=N3)SCC(=O)C4=CC=C(C=C4)Cl |
Product Overview
F3394-1411 (CAS 690642-54-7), with molecular formula C19H17ClN2OS2 and molecular weight 388.05 g/mol. IUPAC: 1-(4-chlorophenyl)-2-(8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5-tetraen-3-ylsulfanyl)ethanone.
Chemical Property Profile of F3394-1411
Property Insights of F3394-1411
The XLogP value of 5.5886 indicates that F3394-1411 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.85 Ų, F3394-1411 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F3394-1411 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3394-1411?
The CAS number of F3394-1411 is 690642-54-7.
What is the molecular formula of F3394-1411?
The molecular formula of F3394-1411 is C19H17ClN2OS2.
What is the molecular weight of F3394-1411?
The molecular weight of F3394-1411 is 388.05 g/mol.
Where can I buy F3394-1411?
You can request a quote for F3394-1411 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-1411?
Yes, KEHONG BIO provides custom synthesis services for F3394-1411 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.