4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one
TL;DR: 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one (CAS 126227-99-4) is a chemical compound with molecular formula C12H10Cl2N2O and molecular weight 268.01703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5-dichloro-2-[(3-methylphenyl)methyl]pyridazin-3-one
Also Known As: 4,5-dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one, 4,5-dichloro-2-(3-methylbenzyl)-3(2H)-pyridazinone, 1H-Benzimidazole, 5,6-dichloro-1-b-D-ribofuranosyl-, 4,5-dichloro-2-(m-tolylmethyl)pyridazin-3-one, 5,6-Dichlorobenzimidazole1-beta-D-Ribofuranoside
Technical Specifications
| Molecular Formula | C12H10Cl2N2O |
| Molecular Weight | 268.01703 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.01703 Da |
| Heavy Atoms | 17 |
| Complexity | 379.0 |
| SMILES | CC1=CC(=CC=C1)CN2C(=O)C(=C(C=N2)Cl)Cl |
| InChIKey | GKYCIQYGTIUXRJ-UHFFFAOYSA-N |
Chemical Property Profile of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one
Property Insights of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one
The XLogP value of 3.0 indicates that 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one?
The CAS number of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one is 126227-99-4.
What is the molecular formula of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one?
The molecular formula of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one is C12H10Cl2N2O.
What is the molecular weight of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one?
The molecular weight of 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one is 268.01703 g/mol.
Where can I buy 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one?
You can request a quote for 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one?
Yes, CoreyChem provides custom synthesis services for 4,5-Dichloro-2-(3-methylbenzyl)pyridazin-3(2h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.