F1684-0247
TL;DR: F1684-0247 (CAS 701239-42-1) is a chemical compound with molecular formula C22H22ClN3O3S2 and molecular weight 475.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methoxyphenyl)-2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide
Also Known As: F1684-0247, N-(5-chloro-2-methoxyphenyl)-2-{[11-(2-methylprop-2-en-1-yl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl}acetamide, N-(5-chloro-2-methoxyphenyl)-2-((3-(2-methylallyl)-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide, N-(5-chloro-2-methoxyphenyl)-2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide, N-(5-chloro-2-methoxyphenyl)[11-(2-methyl-2-propenyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.0(2),]dodeca-1(8),2(6),9-trien-10-ylthio]acetamide
| Molecular Formula | C22H22ClN3O3S2 |
|---|---|
| Molecular Weight | 475.08 g/mol |
| LogP | 4.9156 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.0791 |
| Heavy Atoms | 31 |
| Complexity | 1249.0074 |
Chemical Identifiers
| CAS Number | 701239-42-1 |
|---|---|
| SMILES | CC(=C)CN1C(=O)C2=C(N=C1SCC(=O)NC3=C(C=CC(=C3)Cl)OC)SC4=C2CCC4 |
Product Overview
F1684-0247 (CAS 701239-42-1), with molecular formula C22H22ClN3O3S2 and molecular weight 475.08 g/mol. IUPAC: N-(5-chloro-2-methoxyphenyl)-2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide.
Chemical Property Profile of F1684-0247
Property Insights of F1684-0247
The XLogP value of 4.9156 indicates that F1684-0247 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for F1684-0247. Following Lipinski's Rule of Five, F1684-0247 has 1 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 F1684-0247?
The CAS number of F1684-0247 is 701239-42-1.
What is the molecular formula of F1684-0247?
The molecular formula of F1684-0247 is C22H22ClN3O3S2.
What is the molecular weight of F1684-0247?
The molecular weight of F1684-0247 is 475.08 g/mol.
Where can I buy F1684-0247?
You can request a quote for F1684-0247 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1684-0247?
Yes, KEHONG BIO provides custom synthesis services for F1684-0247 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.