F0539-0002
TL;DR: F0539-0002 (CAS 486453-07-0) is a chemical compound with molecular formula C21H27N3O5S2 and molecular weight 465.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-(diethylsulfamoyl)benzoyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: F0539-0002, methyl 2-(4-(N,N-diethylsulfamoyl)benzamido)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, methyl 2-[[4-(diethylsulfamoyl)benzoyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate, methyl 2-[4-(diethylsulfamoyl)benzamido]-6-methyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C21H27N3O5S2 |
|---|---|
| Molecular Weight | 465.14 g/mol |
| LogP | 2.8054 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 465.13922 |
| Heavy Atoms | 31 |
| Complexity | 1073.1799 |
Chemical Identifiers
| CAS Number | 486453-07-0 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CN(CC3)C)C(=O)OC |
Product Overview
F0539-0002 (CAS 486453-07-0), with molecular formula C21H27N3O5S2 and molecular weight 465.14 g/mol. IUPAC: methyl 2-[[4-(diethylsulfamoyl)benzoyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of F0539-0002
Property Insights of F0539-0002
The XLogP value of 2.8054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0539-0002. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-0002. Following Lipinski's Rule of Five, F0539-0002 has 1 hydrogen bond donor(s) and 7 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 F0539-0002?
The CAS number of F0539-0002 is 486453-07-0.
What is the molecular formula of F0539-0002?
The molecular formula of F0539-0002 is C21H27N3O5S2.
What is the molecular weight of F0539-0002?
The molecular weight of F0539-0002 is 465.14 g/mol.
Where can I buy F0539-0002?
You can request a quote for F0539-0002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-0002?
Yes, KEHONG BIO provides custom synthesis services for F0539-0002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.