F0539-0316
TL;DR: F0539-0316 (CAS 449767-40-2) is a chemical compound with molecular formula C22H27N3O6S2 and molecular weight 493.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-ethyl-2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: F0539-0316, methyl 6-ethyl-2-[4-(morpholine-4-sulfonyl)benzamido]-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate, methyl 6-ethyl-2-(4-(morpholinosulfonyl)benzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, methyl 6-ethyl-2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C22H27N3O6S2 |
|---|---|
| Molecular Weight | 493.13 g/mol |
| LogP | 2.1859 |
| Topological Polar Surface Area | 105.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.13412 |
| Heavy Atoms | 33 |
| Complexity | 1137.6261 |
Chemical Identifiers
| CAS Number | 449767-40-2 |
|---|---|
| SMILES | CCN1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4 |
Product Overview
F0539-0316 (CAS 449767-40-2), with molecular formula C22H27N3O6S2 and molecular weight 493.13 g/mol. IUPAC: methyl 6-ethyl-2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of F0539-0316
Property Insights of F0539-0316
The XLogP value of 2.1859 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0539-0316. The TPSA of 105.25 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-0316. Following Lipinski's Rule of Five, F0539-0316 has 1 hydrogen bond donor(s) and 8 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 F0539-0316?
The CAS number of F0539-0316 is 449767-40-2.
What is the molecular formula of F0539-0316?
The molecular formula of F0539-0316 is C22H27N3O6S2.
What is the molecular weight of F0539-0316?
The molecular weight of F0539-0316 is 493.13 g/mol.
Where can I buy F0539-0316?
You can request a quote for F0539-0316 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-0316?
Yes, KEHONG BIO provides custom synthesis services for F0539-0316 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.