F0539-1871
TL;DR: F0539-1871 (CAS 449782-03-0) is a chemical compound with molecular formula C25H26N4O6S2 and molecular weight 542.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-carbamoyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
Also Known As: F0539-1871, ethyl 3-carbamoyl-2-(4-(N-methyl-N-phenylsulfamoyl)benzamido)-4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate, ethyl 3-carbamoyl-2-{4-[methyl(phenyl)sulfamoyl]benzamido}-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carboxylate, ethyl 3-carbamoyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
| Molecular Formula | C25H26N4O6S2 |
|---|---|
| Molecular Weight | 542.13 g/mol |
| LogP | 3.439 |
| Topological Polar Surface Area | 139.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 542.1294 |
| Heavy Atoms | 37 |
| Complexity | 1435.815 |
Chemical Identifiers
| CAS Number | 449782-03-0 |
|---|---|
| SMILES | CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C4=CC=CC=C4 |
Product Overview
F0539-1871 (CAS 449782-03-0), with molecular formula C25H26N4O6S2 and molecular weight 542.13 g/mol. IUPAC: ethyl 3-carbamoyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate.
Chemical Property Profile of F0539-1871
Property Insights of F0539-1871
The XLogP value of 3.439 indicates that F0539-1871 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.11 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-1871. Following Lipinski's Rule of Five, F0539-1871 has 2 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 F0539-1871?
The CAS number of F0539-1871 is 449782-03-0.
What is the molecular formula of F0539-1871?
The molecular formula of F0539-1871 is C25H26N4O6S2.
What is the molecular weight of F0539-1871?
The molecular weight of F0539-1871 is 542.13 g/mol.
Where can I buy F0539-1871?
You can request a quote for F0539-1871 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-1871?
Yes, KEHONG BIO provides custom synthesis services for F0539-1871 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.