RefChem:509786
TL;DR: RefChem:509786 (CAS 477730-85-1) is a chemical compound with molecular formula C25H17Cl3N2O5S and molecular weight 561.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-[[2-(2,3-dichlorophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 3-chloro-1-benzothiophene-2-carboxylate
Also Known As: 4-((E)-{[(2,3-dichlorophenoxy)acetyl]hydrazono}methyl)-2-methoxyphenyl 3-chloro-1-benzothiophene-2-carboxylate, 4-((E)-(((2,3-Dichlorophenoxy)acetyl)hydrazono)methyl)-2-methoxyphenyl 3-chloro-1-benzothiophene-2-carboxylate, 647-484-5, RefChem:509786
| Molecular Formula | C25H17Cl3N2O5S |
|---|---|
| Molecular Weight | 561.99 g/mol |
| LogP | 6.6184 |
| Topological Polar Surface Area | 86.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 561.9924 |
| Heavy Atoms | 36 |
| Complexity | 1471.6095 |
Chemical Identifiers
| CAS Number | 477730-85-1 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=N/NC(=O)COC2=C(C(=CC=C2)Cl)Cl)OC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
RefChem:509786 (CAS 477730-85-1), with molecular formula C25H17Cl3N2O5S and molecular weight 561.99 g/mol. IUPAC: [4-[(E)-[[2-(2,3-dichlorophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 3-chloro-1-benzothiophene-2-carboxylate.
Chemical Property Profile of RefChem:509786
Property Insights of RefChem:509786
The XLogP value of 6.6184 indicates that RefChem:509786 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.22 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:509786. Following Lipinski's Rule of Five, RefChem:509786 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 RefChem:509786?
The CAS number of RefChem:509786 is 477730-85-1.
What is the molecular formula of RefChem:509786?
The molecular formula of RefChem:509786 is C25H17Cl3N2O5S.
What is the molecular weight of RefChem:509786?
The molecular weight of RefChem:509786 is 561.99 g/mol.
Where can I buy RefChem:509786?
You can request a quote for RefChem:509786 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:509786?
Yes, KEHONG BIO provides custom synthesis services for RefChem:509786 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.