![Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate structure](/static/products/447/447436-28-4.png)
Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate
TL;DR: Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate (CAS 447436-28-4) is a chemical compound with molecular formula C17H19NO4S and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-[(4-methylphenyl)sulfonylamino]benzoate
Also Known As: isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate, propan-2-yl 4-[(4-methylphenyl)sulfonylamino]benzoate, methylethyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate, propan-2-yl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate
| Molecular Formula | C17H19NO4S |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 3.36102 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.1035 |
| Heavy Atoms | 23 |
| Complexity | 778.348 |
Chemical Identifiers
| CAS Number | 447436-28-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC(C)C |
Product Overview
Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate (CAS 447436-28-4), with molecular formula C17H19NO4S and molecular weight 333.10 g/mol. IUPAC: propan-2-yl 4-[(4-methylphenyl)sulfonylamino]benzoate.
Chemical Property Profile of Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate
Property Insights of Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate
The XLogP value of 3.36102 indicates that Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate. Following Lipinski's Rule of Five, Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate has 1 hydrogen bond donor(s) and 4 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 Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate?
The CAS number of Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate is 447436-28-4.
What is the molecular formula of Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate?
The molecular formula of Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate is C17H19NO4S.
What is the molecular weight of Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate?
The molecular weight of Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate is 333.10 g/mol.
Where can I buy Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate?
You can request a quote for Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl 4-{[(4-methylphenyl)sulfonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.