F1298-0401
TL;DR: F1298-0401 (CAS 864927-16-2) is a chemical compound with molecular formula C16H17N3O5S and molecular weight 363.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-cyano-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
Also Known As: F1298-0401, ethyl 3-cyano-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate, ethyl 3-cyano-2-(5,6-dihydro-1,4-dioxine-2-amido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carboxylate, ethyl 3-cyano-2-(5,6-dihydro-1,4-dioxine-2-carboxamido)-4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate, ethyl 3-cyano-2-(5,6-dihydro-1,4-dioxine-2-carboxamido)-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
| Molecular Formula | C16H17N3O5S |
|---|---|
| Molecular Weight | 363.09 g/mol |
| LogP | 1.96108 |
| Topological Polar Surface Area | 100.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.0889 |
| Heavy Atoms | 25 |
| Complexity | 764.5551 |
Chemical Identifiers
| CAS Number | 864927-16-2 |
|---|---|
| SMILES | CCOC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=COCCO3 |
Product Overview
F1298-0401 (CAS 864927-16-2), with molecular formula C16H17N3O5S and molecular weight 363.09 g/mol. IUPAC: ethyl 3-cyano-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate.
Chemical Property Profile of F1298-0401
Property Insights of F1298-0401
The XLogP value of 1.96108 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1298-0401. The TPSA of 100.89 Ų falls within the moderate polarity range, balancing permeability and solubility for F1298-0401. Following Lipinski's Rule of Five, F1298-0401 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 F1298-0401?
The CAS number of F1298-0401 is 864927-16-2.
What is the molecular formula of F1298-0401?
The molecular formula of F1298-0401 is C16H17N3O5S.
What is the molecular weight of F1298-0401?
The molecular weight of F1298-0401 is 363.09 g/mol.
Where can I buy F1298-0401?
You can request a quote for F1298-0401 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1298-0401?
Yes, KEHONG BIO provides custom synthesis services for F1298-0401 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.