F0539-0035
TL;DR: F0539-0035 (CAS 449766-91-0) is a chemical compound with molecular formula C25H27N3O5S2 and molecular weight 513.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: F0539-0035, ethyl 6-methyl-2-{4-[methyl(phenyl)sulfamoyl]benzamido}-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate, ethyl 6-methyl-2-(4-(N-methyl-N-phenylsulfamoyl)benzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, ethyl 6-methyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C25H27N3O5S2 |
|---|---|
| Molecular Weight | 513.14 g/mol |
| LogP | 3.9901 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.1392 |
| Heavy Atoms | 35 |
| Complexity | 1335.4268 |
Chemical Identifiers
| CAS Number | 449766-91-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C4=CC=CC=C4 |
Product Overview
F0539-0035 (CAS 449766-91-0), with molecular formula C25H27N3O5S2 and molecular weight 513.14 g/mol. IUPAC: ethyl 6-methyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of F0539-0035
Property Insights of F0539-0035
The XLogP value of 3.9901 indicates that F0539-0035 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-0035. Following Lipinski's Rule of Five, F0539-0035 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 F0539-0035?
The CAS number of F0539-0035 is 449766-91-0.
What is the molecular formula of F0539-0035?
The molecular formula of F0539-0035 is C25H27N3O5S2.
What is the molecular weight of F0539-0035?
The molecular weight of F0539-0035 is 513.14 g/mol.
Where can I buy F0539-0035?
You can request a quote for F0539-0035 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-0035?
Yes, KEHONG BIO provides custom synthesis services for F0539-0035 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.