3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-
TL;DR: 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- (CAS 64441-02-7) is a chemical compound with molecular formula C10H14N2O3 and molecular weight 210.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexanoyl-1H-pyridazine-3,6-dione
Also Known As: 2-hexanoyl-1H-pyridazine-3,6-dione, 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-, 1,2-Dihydro-1-(1-oxohexyl)-3,6-pyridazinedione, 1-Hexanoyl-1,2-dihydropyridazine-3,6-dione
| Molecular Formula | C10H14N2O3 |
|---|---|
| Molecular Weight | 210.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.10045 |
| Heavy Atoms | 15 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 64441-02-7 |
|---|---|
| SMILES | CCCCCC(=O)N1C(=O)C=CC(=O)N1 |
| InChIKey | MGOVTUYDUDZLSL-UHFFFAOYSA-N |
Product Overview
3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- (CAS 64441-02-7), with molecular formula C10H14N2O3 and molecular weight 210.10 g/mol. IUPAC: 2-hexanoyl-1H-pyridazine-3,6-dione.
Chemical Property Profile of 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-
Property Insights of 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-. Following Lipinski's Rule of Five, 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- has 1 hydrogen bond donor(s) and 3 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 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-?
The CAS number of 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- is 64441-02-7.
What is the molecular formula of 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-?
The molecular formula of 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- is C10H14N2O3.
What is the molecular weight of 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-?
The molecular weight of 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- is 210.10 g/mol.
Where can I buy 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-?
You can request a quote for 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Pyridazinedione, 1,2-dihydro-1-(1-oxohexyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.