6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate
TL;DR: 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate (CAS 16771-19-0) is a chemical compound with molecular formula C11H10N2O4S and molecular weight 266.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-oxo-1H-pyridazin-3-yl) 4-methylbenzenesulfonate
Also Known As: BAS 02561605, 6-hydroxypyridazin-3-yl 4-methylbenzenesulfonate, 6-(toluene-4-sulfonyloxy)-2H-pyridazin-3-one, J2.344.896C, AB00105170-01
| Molecular Formula | C11H10N2O4S |
|---|---|
| Molecular Weight | 266.04 g/mol |
| LogP | 0.84602 |
| Topological Polar Surface Area | 89.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.03613 |
| Heavy Atoms | 18 |
| Complexity | 684.0731 |
Chemical Identifiers
| CAS Number | 16771-19-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=NNC(=O)C=C2 |
Product Overview
6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate (CAS 16771-19-0), with molecular formula C11H10N2O4S and molecular weight 266.04 g/mol. IUPAC: (6-oxo-1H-pyridazin-3-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate
Property Insights of 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate
The XLogP value of 0.84602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate. The TPSA of 89.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate has 1 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 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate?
The CAS number of 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate is 16771-19-0.
What is the molecular formula of 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate?
The molecular formula of 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate is C11H10N2O4S.
What is the molecular weight of 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate?
The molecular weight of 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate is 266.04 g/mol.
Where can I buy 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate?
You can request a quote for 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxypyridazin-3-yl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.