4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate
TL;DR: 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate (CAS 494759-65-8) is a chemical compound with molecular formula C21H17ClN2O5S and molecular weight 444.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-(benzoylhydrazinylidene)methyl]-2-chloro-6-methoxyphenyl] benzenesulfonate
Also Known As: AH-487/40687359, 4-(2-benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate, [4-[(E)-(benzoylhydrazinylidene)methyl]-2-chloro-6-methoxyphenyl] benzenesulfonate, 2-chloro-6-methoxy-4-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}phenyl benzenesulfonate, 4-{[(E)-2-BENZOYLHYDRAZONO]METHYL}-2-CHLORO-6-METHOXYPHENYL 1-BENZENESULFONATE
| Molecular Formula | C21H17ClN2O5S |
|---|---|
| Molecular Weight | 444.05 g/mol |
| LogP | 3.8802 |
| Topological Polar Surface Area | 94.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.05466 |
| Heavy Atoms | 30 |
| Complexity | 1166.761 |
Chemical Identifiers
| CAS Number | 494759-65-8 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2)Cl)OS(=O)(=O)C3=CC=CC=C3 |
Product Overview
4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate (CAS 494759-65-8), with molecular formula C21H17ClN2O5S and molecular weight 444.05 g/mol. IUPAC: [4-[(E)-(benzoylhydrazinylidene)methyl]-2-chloro-6-methoxyphenyl] benzenesulfonate.
Chemical Property Profile of 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate
Property Insights of 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate
The XLogP value of 3.8802 indicates that 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate. Following Lipinski's Rule of Five, 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate 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 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate?
The CAS number of 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate is 494759-65-8.
What is the molecular formula of 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate?
The molecular formula of 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate is C21H17ClN2O5S.
What is the molecular weight of 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate?
The molecular weight of 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate is 444.05 g/mol.
Where can I buy 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate?
You can request a quote for 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Benzoylcarbohydrazonoyl)-2-chloro-6-methoxyphenyl benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.