LY 186126
TL;DR: LY 186126 (CAS 100644-00-6) is a chemical compound with molecular formula C16H19N3O2 and molecular weight 285.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,3-trimethyl-6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)indol-2-one
Also Known As: LY 186126, 1,3,3-trimethyl-6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)indol-2-one, 1,3-Dihydro-1,3,3-dimethyl-5-(1,4,5,6-tetrahydro-4-methyl-6-oxo-3-pyridazinyl)-2H-indol-2-one, 2H-Indol-2-one, 1,3-dihydro-1,3,3-trimethyl-5-(1,4,5,6-tetrahydro-4-methyl-6-oxo-3-pyridazinyl)-, 6-(6-Hydroxy-4-methyl-4,5-dihydropyridazin-3-yl)-1,3,3-trimethyl-1,3-dihydro-2H-indol-2-one
| Molecular Formula | C16H19N3O2 |
|---|---|
| Molecular Weight | 285.15 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.14774 |
| Heavy Atoms | 21 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 100644-00-6 |
|---|---|
| SMILES | CC1CC(=O)NN=C1C2=CC3=C(C=C2)C(C(=O)N3C)(C)C |
| InChIKey | WQKLTCWFSKVPFQ-UHFFFAOYSA-N |
Product Overview
LY 186126 (CAS 100644-00-6), with molecular formula C16H19N3O2 and molecular weight 285.15 g/mol. IUPAC: 1,3,3-trimethyl-6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)indol-2-one.
Chemical Property Profile of LY 186126
Property Insights of LY 186126
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for LY 186126. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for LY 186126. Following Lipinski's Rule of Five, LY 186126 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 LY 186126?
The CAS number of LY 186126 is 100644-00-6.
What is the molecular formula of LY 186126?
The molecular formula of LY 186126 is C16H19N3O2.
What is the molecular weight of LY 186126?
The molecular weight of LY 186126 is 285.15 g/mol.
Where can I buy LY 186126?
You can request a quote for LY 186126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LY 186126?
Yes, KEHONG BIO provides custom synthesis services for LY 186126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.