![2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid structure](/static/products/898/898609-02-4.png)
2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid
TL;DR: 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid (CAS 898609-02-4) is a chemical compound with molecular formula C22H24ClN3O4 and molecular weight 429.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid
Also Known As: 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid, 2-[3-[5-chloro-4-[(4-hydroxyphenyl)amino]-6-oxo-pyridazin-1-yl]-1-adamantyl]acetic Acid, (3-{5-chloro-4-[(4-hydroxyphenyl)amino]-6-oxopyridazin-1(6H)-yl}tricyclo[3.3.1.1~3,7~]dec-1-yl)acetic acid, 2-((1r,3s,5R,7S)-3-(5-chloro-4-((4-hydroxyphenyl)amino)-6-oxopyridazin-1(6H)-yl)adamantan-1-yl)acetic acid, 2-(3-{5-CHLORO-4-[(4-HYDROXYPHENYL)AMINO]-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL}ADAMANTAN-1-YL)ACETIC ACID
| Molecular Formula | C22H24ClN3O4 |
|---|---|
| Molecular Weight | 429.15 g/mol |
| LogP | 4.1161 |
| Topological Polar Surface Area | 104.45 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.14554 |
| Heavy Atoms | 30 |
| Complexity | 1051.0426 |
Chemical Identifiers
| CAS Number | 898609-02-4 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)N4C(=O)C(=C(C=N4)NC5=CC=C(C=C5)O)Cl)CC(=O)O |
Product Overview
2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid (CAS 898609-02-4), with molecular formula C22H24ClN3O4 and molecular weight 429.15 g/mol. IUPAC: 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid.
Chemical Property Profile of 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid
Property Insights of 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid
The XLogP value of 4.1161 indicates that 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid. Following Lipinski's Rule of Five, 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid has 3 hydrogen bond donor(s) and 5 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 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid?
The CAS number of 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid is 898609-02-4.
What is the molecular formula of 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid?
The molecular formula of 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid is C22H24ClN3O4.
What is the molecular weight of 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid?
The molecular weight of 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid is 429.15 g/mol.
Where can I buy 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid?
You can request a quote for 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-[5-chloro-4-(4-hydroxyanilino)-6-oxopyridazin-1-yl]-1-adamantyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.