![4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid structure](/static/products/878/878727-91-4.png)
4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid
TL;DR: 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid (CAS 878727-91-4) is a chemical compound with molecular formula C18H15NO4 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,5-dimethyl-1-benzofuran-2-carbonyl)amino]benzoic acid
Also Known As: BAS 12722084, 4-(3,5-dimethylbenzofuran-2-carboxamido)benzoic acid, 4-[(3,5-dimethyl-1-benzofuran-2-carbonyl)amino]benzoic acid, 4-[(3,5-Dimethyl-benzofuran-2-carbonyl)-amino]-benzoic acid, 4-{[(3,5-dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid
| Molecular Formula | C18H15NO4 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 4.00014 |
| Topological Polar Surface Area | 79.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.1001 |
| Heavy Atoms | 23 |
| Complexity | 906.6663 |
Chemical Identifiers
| CAS Number | 878727-91-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=CC=C(C=C3)C(=O)O |
Product Overview
4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid (CAS 878727-91-4), with molecular formula C18H15NO4 and molecular weight 309.10 g/mol. IUPAC: 4-[(3,5-dimethyl-1-benzofuran-2-carbonyl)amino]benzoic acid.
Chemical Property Profile of 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid
Property Insights of 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid
The XLogP value of 4.00014 indicates that 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid has 2 hydrogen bond donor(s) and 3 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-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid?
The CAS number of 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid is 878727-91-4.
What is the molecular formula of 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid?
The molecular formula of 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid is C18H15NO4.
What is the molecular weight of 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid?
The molecular weight of 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid is 309.10 g/mol.
Where can I buy 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid?
You can request a quote for 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(3,5-Dimethyl-1-benzofuran-2-yl)carbonyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.