1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione
TL;DR: 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione (CAS 1708-46-9) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-1H-pyridazine-3,6-dione
Also Known As: starbld0037634, 2-benzyl-1H-pyridazine-3,6-dione, 2-benzyl-6-hydroxy-3(2H)-pyridazinone, 1-benzyl-1,2-dihydropyridazine-3,6-dione, 2-benzyl-6-hydroxypyridazin-3-one
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 1708-46-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C=CC(=O)N2 |
| InChIKey | JXOUKUODPDOMDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione (CAS 1708-46-9), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: 2-benzyl-1H-pyridazine-3,6-dione.
Chemical Property Profile of 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione
Property Insights of 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione has 1 hydrogen bond donor(s) and 2 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-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione?
The CAS number of 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione is 1708-46-9.
What is the molecular formula of 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione?
The molecular formula of 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione is C11H10N2O2.
What is the molecular weight of 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione?
The molecular weight of 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione is 202.07 g/mol.
Where can I buy 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione?
You can request a quote for 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-1,2,3,6-tetrahydropyridazine-3,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.