![4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester structure](/static/products/797/797782-32-2.png)
4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester
TL;DR: 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester (CAS 797782-32-2) is a chemical compound with molecular formula C18H13NO5S and molecular weight 355.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-2-thiophen-2-ylethyl) 4-(furan-2-carbonylamino)benzoate
Also Known As: BAS 09590587, 2-oxo-2-(2-thienyl)ethyl 4-(2-furoylamino)benzoate, (2-oxo-2-thiophen-2-ylethyl) 4-(furan-2-carbonylamino)benzoate, 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester, 2-oxo-2-(thiophen-2-yl)ethyl 4-(furan-2-carboxamido)benzoate
| Molecular Formula | C18H13NO5S |
|---|---|
| Molecular Weight | 355.05 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 355.05145 |
| Heavy Atoms | 25 |
| Complexity | 504.0 |
Chemical Identifiers
| CAS Number | 797782-32-2 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CS3 |
| InChIKey | QLKBZLGMZRBXFM-UHFFFAOYSA-N |
Product Overview
4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester (CAS 797782-32-2), with molecular formula C18H13NO5S and molecular weight 355.05 g/mol. IUPAC: (2-oxo-2-thiophen-2-ylethyl) 4-(furan-2-carbonylamino)benzoate.
Chemical Property Profile of 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester
Property Insights of 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester
The XLogP value of 3.4 indicates that 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester. Following Lipinski's Rule of Five, 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester 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 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester?
The CAS number of 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester is 797782-32-2.
What is the molecular formula of 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester?
The molecular formula of 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester is C18H13NO5S.
What is the molecular weight of 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester?
The molecular weight of 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester is 355.05 g/mol.
Where can I buy 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester?
You can request a quote for 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Furan-2-carbonyl)-amino]-benzoic acid 2-oxo-2-thiophen-2-yl-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.