RefChem:269539
TL;DR: RefChem:269539 (CAS 112518-03-3) is a chemical compound with molecular formula C18H14ClN3OS and molecular weight 355.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-chlorophenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-4,5-dihydropyridazin-3-one
Also Known As: 3(2H)-Pyridazinone, 4,5-dihydro-6-(4-chlorophenyl)-2-(6-methyl-2-benzothiazolyl)-, 4,5-Dihydro-6-(4-chlorophenyl)-2-(6-methyl-2-benzothiazolyl)-3(2H)-pyridazinone, 6-(4-Chlorophenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-4,5-dihydropyridazin-3(2H)-one, 6-(4-chlorophenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-4,5-dihydropyridazin-3-one, RefChem:269539
| Molecular Formula | C18H14ClN3OS |
|---|---|
| Molecular Weight | 355.05 g/mol |
| LogP | 4.78922 |
| Topological Polar Surface Area | 45.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.0546 |
| Heavy Atoms | 24 |
| Complexity | 962.05927 |
Chemical Identifiers
| CAS Number | 112518-03-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)N3C(=O)CCC(=N3)C4=CC=C(C=C4)Cl |
Product Overview
RefChem:269539 (CAS 112518-03-3), with molecular formula C18H14ClN3OS and molecular weight 355.05 g/mol. IUPAC: 6-(4-chlorophenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-4,5-dihydropyridazin-3-one.
Chemical Property Profile of RefChem:269539
Property Insights of RefChem:269539
The XLogP value of 4.78922 indicates that RefChem:269539 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.56 Ų, RefChem:269539 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:269539 has 0 hydrogen bond donor(s) and 4 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 RefChem:269539?
The CAS number of RefChem:269539 is 112518-03-3.
What is the molecular formula of RefChem:269539?
The molecular formula of RefChem:269539 is C18H14ClN3OS.
What is the molecular weight of RefChem:269539?
The molecular weight of RefChem:269539 is 355.05 g/mol.
Where can I buy RefChem:269539?
You can request a quote for RefChem:269539 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:269539?
Yes, KEHONG BIO provides custom synthesis services for RefChem:269539 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.