F3394-1238
TL;DR: F3394-1238 (CAS 727689-63-6) is a chemical compound with molecular formula C21H20N2O3S3 and molecular weight 444.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: F3394-1238, ETHYL 2-{2-[(4-PHENYL-1,3-THIAZOL-2-YL)SULFANYL]ACETAMIDO}-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE, ethyl 2-(2-((4-phenylthiazol-2-yl)thio)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 3-{[(4-phenyl-1,3-thiazol-2-ylthio)methyl]carbonylamino}-2-thiabicyclo[3.3.0]octa-1(5),3-diene-4-carboxylate
| Molecular Formula | C21H20N2O3S3 |
|---|---|
| Molecular Weight | 444.06 g/mol |
| LogP | 5.2678 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.0636 |
| Heavy Atoms | 29 |
| Complexity | 1027.2283 |
Chemical Identifiers
| CAS Number | 727689-63-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NC(=CS3)C4=CC=CC=C4 |
Product Overview
F3394-1238 (CAS 727689-63-6), with molecular formula C21H20N2O3S3 and molecular weight 444.06 g/mol. IUPAC: ethyl 2-[[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of F3394-1238
Property Insights of F3394-1238
The XLogP value of 5.2678 indicates that F3394-1238 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-1238. Following Lipinski's Rule of Five, F3394-1238 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3394-1238?
The CAS number of F3394-1238 is 727689-63-6.
What is the molecular formula of F3394-1238?
The molecular formula of F3394-1238 is C21H20N2O3S3.
What is the molecular weight of F3394-1238?
The molecular weight of F3394-1238 is 444.06 g/mol.
Where can I buy F3394-1238?
You can request a quote for F3394-1238 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-1238?
Yes, KEHONG BIO provides custom synthesis services for F3394-1238 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.