Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester
TL;DR: Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester (CAS 69579-05-1) is a chemical compound with molecular formula C13H19ClN4O2 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl (4E)-4-[(6-chloropyridazin-3-yl)hydrazinylidene]pentanoate
Also Known As: 5-25-17-00363 (Beilstein Handbook Reference), 4-(2-(6-Chloro-3-pyridazinyl)hydrazinylidene)valeric acid tert-butyl ester, Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester, Pentanoic acid, 4-((6-chloro-3-pyridazinyl)hydrazono)-, 1,1-dimethylethyl ester, RefChem:1100910
| Molecular Formula | C13H19ClN4O2 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 3.0397 |
| Topological Polar Surface Area | 76.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.11966 |
| Heavy Atoms | 20 |
| Complexity | 480.13968 |
Chemical Identifiers
| CAS Number | 69579-05-1 |
|---|---|
| SMILES | C/C(=N\NC1=NN=C(C=C1)Cl)/CCC(=O)OC(C)(C)C |
Product Overview
Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester (CAS 69579-05-1), with molecular formula C13H19ClN4O2 and molecular weight 298.12 g/mol. IUPAC: tert-butyl (4E)-4-[(6-chloropyridazin-3-yl)hydrazinylidene]pentanoate.
Chemical Property Profile of Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester
Property Insights of Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester
The XLogP value of 3.0397 indicates that Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester. Following Lipinski's Rule of Five, Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester has 1 hydrogen bond donor(s) and 6 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 Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester?
The CAS number of Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester is 69579-05-1.
What is the molecular formula of Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester?
The molecular formula of Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester is C13H19ClN4O2.
What is the molecular weight of Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester?
The molecular weight of Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester is 298.12 g/mol.
Where can I buy Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester?
You can request a quote for Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester?
Yes, KEHONG BIO provides custom synthesis services for Valeric acid, 4-(2-(6-chloro-3-pyridazinyl)hydrazinylidene)-, tert-butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.