A1000/0046800
TL;DR: A1000/0046800 (CAS 339261-91-5) is a chemical compound with molecular formula C24H20BrClN2O6 and molecular weight 546.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[[[2-(2-bromo-4-chlorophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 3-methoxybenzoate
Also Known As: A1000/0046800, 4-[[2-[2-(2-Bromo-4-chlorophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl 3-methoxybenzoate, [4-[[[2-(2-bromo-4-chlorophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 3-methoxybenzoate, 4-({2-[(2-Bromo-4-chlorophenoxy)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl 3-methoxybenzoate
| Molecular Formula | C24H20BrClN2O6 |
|---|---|
| Molecular Weight | 546.02 g/mol |
| LogP | 4.868 |
| Topological Polar Surface Area | 95.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 546.01935 |
| Heavy Atoms | 34 |
| Complexity | 1217.8176 |
Chemical Identifiers
| CAS Number | 339261-91-5 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=O)COC3=C(C=C(C=C3)Cl)Br)OC |
Product Overview
A1000/0046800 (CAS 339261-91-5), with molecular formula C24H20BrClN2O6 and molecular weight 546.02 g/mol. IUPAC: [4-[[[2-(2-bromo-4-chlorophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 3-methoxybenzoate.
Chemical Property Profile of A1000/0046800
Property Insights of A1000/0046800
The XLogP value of 4.868 indicates that A1000/0046800 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.45 Ų falls within the moderate polarity range, balancing permeability and solubility for A1000/0046800. Following Lipinski's Rule of Five, A1000/0046800 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1000/0046800?
The CAS number of A1000/0046800 is 339261-91-5.
What is the molecular formula of A1000/0046800?
The molecular formula of A1000/0046800 is C24H20BrClN2O6.
What is the molecular weight of A1000/0046800?
The molecular weight of A1000/0046800 is 546.02 g/mol.
Where can I buy A1000/0046800?
You can request a quote for A1000/0046800 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1000/0046800?
Yes, KEHONG BIO provides custom synthesis services for A1000/0046800 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.