![Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate structure](/static/products/872/87299-71-6.png)
Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate
TL;DR: Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate (CAS 87299-71-6) is a chemical compound with molecular formula C13H20N2O6S and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 5-(butylcarbamoylsulfamoyl)furan-2-carboxylate
Also Known As: BAS 03375145, AL-281/40679329, isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate, propan-2-yl 5-(butylcarbamoylsulfamoyl)furan-2-carboxylate, N-(5-isopropoxycarbonyl-2-furylsulfonyl)-N'-butylurea
| Molecular Formula | C13H20N2O6S |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 332.10422 |
| Heavy Atoms | 22 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 87299-71-6 |
|---|---|
| SMILES | CCCCNC(=O)NS(=O)(=O)C1=CC=C(O1)C(=O)OC(C)C |
| InChIKey | CBXVSNAYNRZZDC-UHFFFAOYSA-N |
Product Overview
Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate (CAS 87299-71-6), with molecular formula C13H20N2O6S and molecular weight 332.10 g/mol. IUPAC: propan-2-yl 5-(butylcarbamoylsulfamoyl)furan-2-carboxylate.
Chemical Property Profile of Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate
Property Insights of Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate. Following Lipinski's Rule of Five, Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate has 2 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 Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate?
The CAS number of Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate is 87299-71-6.
What is the molecular formula of Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate?
The molecular formula of Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate is C13H20N2O6S.
What is the molecular weight of Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate?
The molecular weight of Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate is 332.10 g/mol.
Where can I buy Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate?
You can request a quote for Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl 5-({[(butylamino)carbonyl]amino}sulfonyl)-2-furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.