![Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate structure](/static/products/6967/6967-22-2.webp)
Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate
TL;DR: Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate (CAS 6967-22-2) is a chemical compound with molecular formula C16H23NO6S and molecular weight 357.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate
Also Known As: diethyl n-[(4-methylphenyl)sulfonyl]glutamate, diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate
| Molecular Formula | C16H23NO6S |
|---|---|
| Molecular Weight | 357.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 357.1246 |
| Heavy Atoms | 24 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 6967-22-2 |
|---|---|
| SMILES | CCOC(=O)CCC(C(=O)OCC)NS(=O)(=O)C1=CC=C(C=C1)C |
| InChIKey | ALFGIFHISQNDJG-UHFFFAOYSA-N |
Product Overview
Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate (CAS 6967-22-2), with molecular formula C16H23NO6S and molecular weight 357.12 g/mol. IUPAC: diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate.
Chemical Property Profile of Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate
Property Insights of Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate. Following Lipinski's Rule of Five, Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate has 1 hydrogen bond donor(s) and 7 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 Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate?
The CAS number of Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate is 6967-22-2.
What is the molecular formula of Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate?
The molecular formula of Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate is C16H23NO6S.
What is the molecular weight of Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate?
The molecular weight of Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate is 357.12 g/mol.
Where can I buy Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate?
You can request a quote for Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[(4-methylphenyl)sulfonylamino]pentanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.