![Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate structure](/static/products/931/93100-73-3.png)
Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate
TL;DR: Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate (CAS 93100-73-3) is a chemical compound with molecular formula C14H18N2O6S and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate
Also Known As: diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate, NCI60_030502, diethyl 2-[(4-sulfamoylanilino)methylene]propanedioate, diethyl 2-(((4-sulfamoylphenyl)amino)methylene)malonate, diethyl{[(4-sulfamoylphenyl)amino]methylene}malonate
| Molecular Formula | C14H18N2O6S |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 342.08856 |
| Heavy Atoms | 23 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 93100-73-3 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=CC=C(C=C1)S(=O)(=O)N)C(=O)OCC |
| InChIKey | LPDIOFUETVAFIF-UHFFFAOYSA-N |
Product Overview
Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate (CAS 93100-73-3), with molecular formula C14H18N2O6S and molecular weight 342.09 g/mol. IUPAC: diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate.
Chemical Property Profile of Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate
Property Insights of Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate. Following Lipinski's Rule of Five, Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate has 2 hydrogen bond donor(s) and 8 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-sulfamoylanilino)methylidene]propanedioate?
The CAS number of Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate is 93100-73-3.
What is the molecular formula of Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate?
The molecular formula of Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate is C14H18N2O6S.
What is the molecular weight of Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate?
The molecular weight of Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate is 342.09 g/mol.
Where can I buy Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate?
You can request a quote for Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate 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-sulfamoylanilino)methylidene]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[(4-sulfamoylanilino)methylidene]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.