AB00617409-02
TL;DR: AB00617409-02 (CAS 864858-64-0) is a chemical compound with molecular formula C15H12N4O5S and molecular weight 360.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-5-nitrofuran-2-carboxamide
Also Known As: AB00617409-02, F1298-0861, N-(6-acetyl-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-5-nitrofuran-2-carboxamide, N-{6-acetyl-3-cyano-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl}-5-nitrofuran-2-carboxamide, N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-5-nitrofuran-2-carboxamide
| Molecular Formula | C15H12N4O5S |
|---|---|
| Molecular Weight | 360.05 g/mol |
| LogP | 2.27788 |
| Topological Polar Surface Area | 129.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 360.05283 |
| Heavy Atoms | 25 |
| Complexity | 922.9871 |
Chemical Identifiers
| CAS Number | 864858-64-0 |
|---|---|
| SMILES | CC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(O3)[N+](=O)[O-] |
Product Overview
AB00617409-02 (CAS 864858-64-0), with molecular formula C15H12N4O5S and molecular weight 360.05 g/mol. IUPAC: N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-5-nitrofuran-2-carboxamide.
Chemical Property Profile of AB00617409-02
Property Insights of AB00617409-02
The XLogP value of 2.27788 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00617409-02. The TPSA of 129.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00617409-02. Following Lipinski's Rule of Five, AB00617409-02 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 AB00617409-02?
The CAS number of AB00617409-02 is 864858-64-0.
What is the molecular formula of AB00617409-02?
The molecular formula of AB00617409-02 is C15H12N4O5S.
What is the molecular weight of AB00617409-02?
The molecular weight of AB00617409-02 is 360.05 g/mol.
Where can I buy AB00617409-02?
You can request a quote for AB00617409-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00617409-02?
Yes, KEHONG BIO provides custom synthesis services for AB00617409-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.