3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-
TL;DR: 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- (CAS 331858-20-9) is a chemical compound with molecular formula C9H13ClN2O2 and molecular weight 216.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-4-chloro-5-methoxypyridazin-3-one
Also Known As: 2-(tert-Butyl)-4-chloro-5-methoxypyridazin-3(2H)-one, 2-tert-butyl-4-chloro-5-methoxypyridazin-3-one, 2-tert-butyl-4-chloro-5-methoxy-3(2H)-pyridazinone, AB00081578-01, 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-
| Molecular Formula | C9H13ClN2O2 |
|---|---|
| Molecular Weight | 216.07 g/mol |
| LogP | 1.6603 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.06656 |
| Heavy Atoms | 14 |
| Complexity | 392.77893 |
Chemical Identifiers
| CAS Number | 331858-20-9 |
|---|---|
| SMILES | CC(C)(C)N1C(=O)C(=C(C=N1)OC)Cl |
Product Overview
3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- (CAS 331858-20-9), with molecular formula C9H13ClN2O2 and molecular weight 216.07 g/mol. IUPAC: 2-tert-butyl-4-chloro-5-methoxypyridazin-3-one.
Chemical Property Profile of 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-
Property Insights of 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-
The XLogP value of 1.6603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-. With a topological polar surface area (TPSA) of 44.12 Ų, 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- has 0 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(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-?
The CAS number of 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- is 331858-20-9.
What is the molecular formula of 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-?
The molecular formula of 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- is C9H13ClN2O2.
What is the molecular weight of 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-?
The molecular weight of 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- is 216.07 g/mol.
Where can I buy 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-?
You can request a quote for 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.