4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone
TL;DR: 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone (CAS 1016-06-4) is a chemical compound with molecular formula C10H14ClN3O and molecular weight 227.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-methyl-5-piperidin-1-ylpyridazin-3-one
Also Known As: 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone, AE-641/00566052, 4-chloro-2-methyl-5-piperidin-1-ylpyridazin-3-one, Pyridazin-3(2H)-one, 4-chloro-2-methyl-5-(1-piperidyl)-, 4-Chloro-2-methyl-5-(piperidin-1-yl)pyridazin-3(2H)-one
| Molecular Formula | C10H14ClN3O |
|---|---|
| Molecular Weight | 227.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.08253 |
| Heavy Atoms | 15 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 1016-06-4 |
|---|---|
| SMILES | CN1C(=O)C(=C(C=N1)N2CCCCC2)Cl |
| InChIKey | HFDNAAGDKCGKRY-UHFFFAOYSA-N |
Product Overview
4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone (CAS 1016-06-4), with molecular formula C10H14ClN3O and molecular weight 227.08 g/mol. IUPAC: 4-chloro-2-methyl-5-piperidin-1-ylpyridazin-3-one.
Chemical Property Profile of 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone
Property Insights of 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone. With a topological polar surface area (TPSA) of 35.9 Ų, 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone 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 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone?
The CAS number of 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone is 1016-06-4.
What is the molecular formula of 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone?
The molecular formula of 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone is C10H14ClN3O.
What is the molecular weight of 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone?
The molecular weight of 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone is 227.08 g/mol.
Where can I buy 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone?
You can request a quote for 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-methyl-5-(1-piperidinyl)-3(2H)-pyridazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.