F0539-1789
TL;DR: F0539-1789 (CAS 449770-54-1) is a chemical compound with molecular formula C25H33N3O7S2 and molecular weight 551.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-O-ethyl 3-O-methyl 2-[[4-[butyl(ethyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate
Also Known As: F0539-1789, 6-ethyl 3-methyl 2-(4-(N-butyl-N-ethylsulfamoyl)benzamido)-4,5-dihydrothieno[2,3-c]pyridine-3,6(7H)-dicarboxylate, 6-ethyl 3-methyl 2-{4-[butyl(ethyl)sulfamoyl]benzamido}-4H,5H,6H,7H-thieno[2,3-c]pyridine-3,6-dicarboxylate, 6-O-ethyl 3-O-methyl 2-[[4-[butyl(ethyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate
| Molecular Formula | C25H33N3O7S2 |
|---|---|
| Molecular Weight | 551.18 g/mol |
| LogP | 4.1123 |
| Topological Polar Surface Area | 122.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 551.17596 |
| Heavy Atoms | 37 |
| Complexity | 1239.7217 |
Chemical Identifiers
| CAS Number | 449770-54-1 |
|---|---|
| SMILES | CCCCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CN(CC3)C(=O)OCC)C(=O)OC |
Product Overview
F0539-1789 (CAS 449770-54-1), with molecular formula C25H33N3O7S2 and molecular weight 551.18 g/mol. IUPAC: 6-O-ethyl 3-O-methyl 2-[[4-[butyl(ethyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate.
Chemical Property Profile of F0539-1789
Property Insights of F0539-1789
The XLogP value of 4.1123 indicates that F0539-1789 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.32 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-1789. Following Lipinski's Rule of Five, F0539-1789 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0539-1789?
The CAS number of F0539-1789 is 449770-54-1.
What is the molecular formula of F0539-1789?
The molecular formula of F0539-1789 is C25H33N3O7S2.
What is the molecular weight of F0539-1789?
The molecular weight of F0539-1789 is 551.18 g/mol.
Where can I buy F0539-1789?
You can request a quote for F0539-1789 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-1789?
Yes, KEHONG BIO provides custom synthesis services for F0539-1789 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.