1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol
TL;DR: 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol (CAS 83539-90-6) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-2-pyridazin-3-ylethanol
Also Known As: 1-(1,3-benzodioxol-5-yl)-2-pyridazin-3-ylethanol, 1-(2H-1,3-Benzodioxol-5-yl)-2-(pyridazin-3-yl)ethan-1-ol
| Molecular Formula | C13H12N2O3 |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 64.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.0848 |
| Heavy Atoms | 18 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 83539-90-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(CC3=NN=CC=C3)O |
| InChIKey | JPGUQRFTPCNMCV-UHFFFAOYSA-N |
Product Overview
1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol (CAS 83539-90-6), with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-2-pyridazin-3-ylethanol.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol
Property Insights of 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol. The TPSA of 64.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol 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 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol is 83539-90-6.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol is C13H12N2O3.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol is 244.08 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-2-pyridazin-3-ylethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.