Bionet1_000513
TL;DR: Bionet1_000513 (CAS 338405-77-9) is a chemical compound with molecular formula C19H15ClN2O3S and molecular weight 386.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(4-chlorophenyl)-4-(4-methylphenyl)sulfanyl-6-oxopyridazine-3-carboxylate
Also Known As: Bionet1_000513, methyl 1-(4-chlorophenyl)-4-[(4-methylphenyl)sulfanyl]-6-oxo-1,6-dihydro-3-pyridazinecarboxylate, 3F-099, methyl 1-(4-chlorophenyl)-4-[(4-methylphenyl)sulfanyl]-6-oxo-1,6-dihydropyridazine-3-carboxylate, methyl 1-(4-chlorophenyl)-4-(4-methylphenyl)sulfanyl-6-oxopyridazine-3-carboxylate
| Molecular Formula | C19H15ClN2O3S |
|---|---|
| Molecular Weight | 386.05 g/mol |
| LogP | 4.13212 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.0492 |
| Heavy Atoms | 26 |
| Complexity | 998.78796 |
Chemical Identifiers
| CAS Number | 338405-77-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2=CC(=O)N(N=C2C(=O)OC)C3=CC=C(C=C3)Cl |
Product Overview
Bionet1_000513 (CAS 338405-77-9), with molecular formula C19H15ClN2O3S and molecular weight 386.05 g/mol. IUPAC: methyl 1-(4-chlorophenyl)-4-(4-methylphenyl)sulfanyl-6-oxopyridazine-3-carboxylate.
Chemical Property Profile of Bionet1_000513
Property Insights of Bionet1_000513
The XLogP value of 4.13212 indicates that Bionet1_000513 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000513. Following Lipinski's Rule of Five, Bionet1_000513 has 0 hydrogen bond donor(s) and 5 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_000513?
The CAS number of Bionet1_000513 is 338405-77-9.
What is the molecular formula of Bionet1_000513?
The molecular formula of Bionet1_000513 is C19H15ClN2O3S.
What is the molecular weight of Bionet1_000513?
The molecular weight of Bionet1_000513 is 386.05 g/mol.
Where can I buy Bionet1_000513?
You can request a quote for Bionet1_000513 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000513?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000513 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.