3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one
TL;DR: 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one (CAS 138651-66-8) is a chemical compound with molecular formula C10H8ClN3O and molecular weight 221.03558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one
Also Known As: 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one, 3-(3-amino-phenyl)-6-chloro-pyridazin-4-ol
Technical Specifications
| Molecular Formula | C10H8ClN3O |
| Molecular Weight | 221.03558 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.03558 Da |
| Heavy Atoms | 15 |
| Complexity | 338.0 |
| SMILES | C1=CC(=CC(=C1)N)C2=NNC(=CC2=O)Cl |
| InChIKey | VGBVGBGSMVGHAZ-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one
Property Insights of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one. Following Lipinski's Rule of Five, 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one?
The CAS number of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one is 138651-66-8.
What is the molecular formula of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one?
The molecular formula of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one is C10H8ClN3O.
What is the molecular weight of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one?
The molecular weight of 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one is 221.03558 g/mol.
Where can I buy 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one?
You can request a quote for 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one?
Yes, CoreyChem provides custom synthesis services for 3-(3-aminophenyl)-6-chloro-1H-pyridazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.