![2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate structure](/static/products/825/82518-82-9.png)
2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate
TL;DR: 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate (CAS 82518-82-9) is a chemical compound with molecular formula C20H19NO5S2 and molecular weight 417.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(4-methylphenyl)sulfonylamino]phenyl] 4-methylbenzenesulfonate
Also Known As: o,N-Diparatoluenesulfonyl[2-aminophenol], 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate, p-Toluenesulfonic acid 2-(tosylamino)phenyl ester, 2-{[(4-methylphenyl)sulfonyl]amino}phenyl 4-methylbenzenesulfonate, [2-[(4-methylphenyl)sulfonylamino]phenyl] 4-methylbenzenesulfonate
| Molecular Formula | C20H19NO5S2 |
|---|---|
| Molecular Weight | 417.07 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.07047 |
| Heavy Atoms | 28 |
| Complexity | 694.0 |
Chemical Identifiers
| CAS Number | 82518-82-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C |
| InChIKey | ZAPUUYNFQUEIBP-UHFFFAOYSA-N |
Product Overview
2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate (CAS 82518-82-9), with molecular formula C20H19NO5S2 and molecular weight 417.07 g/mol. IUPAC: [2-[(4-methylphenyl)sulfonylamino]phenyl] 4-methylbenzenesulfonate.
Chemical Property Profile of 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate
Property Insights of 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate
The XLogP value of 4.1 indicates that 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate 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 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate?
The CAS number of 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate is 82518-82-9.
What is the molecular formula of 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate?
The molecular formula of 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate is C20H19NO5S2.
What is the molecular weight of 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate?
The molecular weight of 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate is 417.07 g/mol.
Where can I buy 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate?
You can request a quote for 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-([(4-Methylphenyl)sulfonyl]amino)phenyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.