Bionet1_003382
TL;DR: Bionet1_003382 (CAS 672951-63-2) is a chemical compound with molecular formula C13H9ClN2O4S2 and molecular weight 355.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(7,7-dioxo-5,6-dihydrothieno[2,3-b]thiopyran-4-ylidene)amino] 6-chloropyridine-3-carboxylate
Also Known As: Bionet1_003382, [(7,7-dioxo-5,6-dihydrothieno[2,3-b]thiopyran-4-ylidene)amino] 6-chloropyridine-3-carboxylate, 4-({[(6-chloro-3-pyridinyl)carbonyl]oxy}imino)-3,4-dihydro-1lambda~6~-thieno[2,3-b]thiopyran-1,1(2H)-dione
| Molecular Formula | C13H9ClN2O4S2 |
|---|---|
| Molecular Weight | 355.97 g/mol |
| LogP | 2.535 |
| Topological Polar Surface Area | 85.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.96924 |
| Heavy Atoms | 22 |
| Complexity | 856.42017 |
Chemical Identifiers
| CAS Number | 672951-63-2 |
|---|---|
| SMILES | C1CS(=O)(=O)C2=C(C1=NOC(=O)C3=CN=C(C=C3)Cl)C=CS2 |
Product Overview
Bionet1_003382 (CAS 672951-63-2), with molecular formula C13H9ClN2O4S2 and molecular weight 355.97 g/mol. IUPAC: [(7,7-dioxo-5,6-dihydrothieno[2,3-b]thiopyran-4-ylidene)amino] 6-chloropyridine-3-carboxylate.
Chemical Property Profile of Bionet1_003382
Property Insights of Bionet1_003382
The XLogP value of 2.535 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_003382. The TPSA of 85.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_003382. Following Lipinski's Rule of Five, Bionet1_003382 has 0 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 Bionet1_003382?
The CAS number of Bionet1_003382 is 672951-63-2.
What is the molecular formula of Bionet1_003382?
The molecular formula of Bionet1_003382 is C13H9ClN2O4S2.
What is the molecular weight of Bionet1_003382?
The molecular weight of Bionet1_003382 is 355.97 g/mol.
Where can I buy Bionet1_003382?
You can request a quote for Bionet1_003382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003382?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.