Bionet1_000507
TL;DR: Bionet1_000507 (CAS 338405-50-8) is a chemical compound with molecular formula C17H12ClN3O3S and molecular weight 373.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(4-chlorophenyl)-6-oxo-4-pyridin-2-ylsulfanylpyridazine-3-carboxylate
Also Known As: Bionet1_000507, 3F-080, methyl 1-(4-chlorophenyl)-6-oxo-4-(2-pyridinylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate, methyl 1-(4-chlorophenyl)-6-oxo-4-pyridin-2-ylsulfanylpyridazine-3-carboxylate, methyl 1-(4-chlorophenyl)-6-oxo-4-(pyridin-2-ylsulfanyl)-1,6-dihydropyridazine-3-carboxylate
| Molecular Formula | C17H12ClN3O3S |
|---|---|
| Molecular Weight | 373.03 g/mol |
| LogP | 3.2187 |
| Topological Polar Surface Area | 74.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.02878 |
| Heavy Atoms | 25 |
| Complexity | 959.12213 |
Chemical Identifiers
| CAS Number | 338405-50-8 |
|---|---|
| SMILES | COC(=O)C1=NN(C(=O)C=C1SC2=CC=CC=N2)C3=CC=C(C=C3)Cl |
Product Overview
Bionet1_000507 (CAS 338405-50-8), with molecular formula C17H12ClN3O3S and molecular weight 373.03 g/mol. IUPAC: methyl 1-(4-chlorophenyl)-6-oxo-4-pyridin-2-ylsulfanylpyridazine-3-carboxylate.
Chemical Property Profile of Bionet1_000507
Property Insights of Bionet1_000507
The XLogP value of 3.2187 indicates that Bionet1_000507 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000507. Following Lipinski's Rule of Five, Bionet1_000507 has 0 hydrogen bond donor(s) and 6 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_000507?
The CAS number of Bionet1_000507 is 338405-50-8.
What is the molecular formula of Bionet1_000507?
The molecular formula of Bionet1_000507 is C17H12ClN3O3S.
What is the molecular weight of Bionet1_000507?
The molecular weight of Bionet1_000507 is 373.03 g/mol.
Where can I buy Bionet1_000507?
You can request a quote for Bionet1_000507 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000507?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000507 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.