F0539-0313
TL;DR: F0539-0313 (CAS 486453-34-3) is a chemical compound with molecular formula C24H31N3O5S2 and molecular weight 505.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-ethyl-2-[[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: F0539-0313, methyl 6-ethyl-2-{4-[(4-methylpiperidin-1-yl)sulfonyl]benzamido}-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate, methyl 6-ethyl-2-(4-((4-methylpiperidin-1-yl)sulfonyl)benzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, methyl 6-ethyl-2-[[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate, 4-methyl-1-piperidyl(oxo)-p-(N-6-ethyl-3-methoxycarbonyl-1-thia-6-aza-4,5,6,7-tetrahydro-2-indenylcarbamoyl)phenyl-lambda-sulfaniumolate
| Molecular Formula | C24H31N3O5S2 |
|---|---|
| Molecular Weight | 505.17 g/mol |
| LogP | 3.5856 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.1705 |
| Heavy Atoms | 34 |
| Complexity | 1165.9604 |
Chemical Identifiers
| CAS Number | 486453-34-3 |
|---|---|
| SMILES | CCN1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)C |
Product Overview
F0539-0313 (CAS 486453-34-3), with molecular formula C24H31N3O5S2 and molecular weight 505.17 g/mol. IUPAC: methyl 6-ethyl-2-[[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of F0539-0313
Property Insights of F0539-0313
The XLogP value of 3.5856 indicates that F0539-0313 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 F0539-0313. Following Lipinski's Rule of Five, F0539-0313 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 F0539-0313?
The CAS number of F0539-0313 is 486453-34-3.
What is the molecular formula of F0539-0313?
The molecular formula of F0539-0313 is C24H31N3O5S2.
What is the molecular weight of F0539-0313?
The molecular weight of F0539-0313 is 505.17 g/mol.
Where can I buy F0539-0313?
You can request a quote for F0539-0313 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-0313?
Yes, KEHONG BIO provides custom synthesis services for F0539-0313 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.