A0488/0022620
TL;DR: A0488/0022620 (CAS 339083-94-2) is a chemical compound with molecular formula C16H14N4O6 and molecular weight 358.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-3-nitro-4-[(E)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] acetate
Also Known As: A0488/0022620, 2-methoxy-3-nitro-4-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}phenyl acetate, (E)-4-((2-isonicotinoylhydrazono)methyl)-2-methoxy-3-nitrophenyl acetate, [2-methoxy-3-nitro-4-[(E)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] acetate, 2-METHOXY-3-NITRO-4-[(E)-{[(PYRIDIN-4-YL)FORMAMIDO]IMINO}METHYL]PHENYL ACETATE
| Molecular Formula | C16H14N4O6 |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | 1.6876 |
| Topological Polar Surface Area | 133.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.09134 |
| Heavy Atoms | 26 |
| Complexity | 866.54376 |
Chemical Identifiers
| CAS Number | 339083-94-2 |
|---|---|
| SMILES | CC(=O)OC1=C(C(=C(C=C1)/C=N/NC(=O)C2=CC=NC=C2)[N+](=O)[O-])OC |
Product Overview
A0488/0022620 (CAS 339083-94-2), with molecular formula C16H14N4O6 and molecular weight 358.09 g/mol. IUPAC: [2-methoxy-3-nitro-4-[(E)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] acetate.
Chemical Property Profile of A0488/0022620
Property Insights of A0488/0022620
The XLogP value of 1.6876 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A0488/0022620. The TPSA of 133.02 Ų falls within the moderate polarity range, balancing permeability and solubility for A0488/0022620. Following Lipinski's Rule of Five, A0488/0022620 has 1 hydrogen bond donor(s) and 8 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 A0488/0022620?
The CAS number of A0488/0022620 is 339083-94-2.
What is the molecular formula of A0488/0022620?
The molecular formula of A0488/0022620 is C16H14N4O6.
What is the molecular weight of A0488/0022620?
The molecular weight of A0488/0022620 is 358.09 g/mol.
Where can I buy A0488/0022620?
You can request a quote for A0488/0022620 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0488/0022620?
Yes, KEHONG BIO provides custom synthesis services for A0488/0022620 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.