![3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid structure](/static/products/313/313482-91-6.png)
3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid
TL;DR: 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid (CAS 313482-91-6) is a chemical compound with molecular formula C19H14N2O4S and molecular weight 366.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3-(thiophene-2-carbonylamino)benzoyl]amino]benzoic acid
Also Known As: CZL80, 3-[[3-(thiophene-2-carbonylamino)benzoyl]amino]benzoic Acid, 3-(3-(Thiophene-2-carboxamido)benzamido)benzoic acid, 3-[3-(THIOPHENE-2-AMIDO)BENZAMIDO]BENZOIC ACID, 3-{[3-(2-thienylcarbonylamino)phenyl]carbonylamino}benzoic acid
| Molecular Formula | C19H14N2O4S |
|---|---|
| Molecular Weight | 366.07 g/mol |
| LogP | 3.9509 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.0674 |
| Heavy Atoms | 26 |
| Complexity | 967.1852 |
Chemical Identifiers
| CAS Number | 313482-91-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)NC3=CC=CC(=C3)C(=O)O |
Product Overview
3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid (CAS 313482-91-6), with molecular formula C19H14N2O4S and molecular weight 366.07 g/mol. IUPAC: 3-[[3-(thiophene-2-carbonylamino)benzoyl]amino]benzoic acid.
Chemical Property Profile of 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid
Property Insights of 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid
The XLogP value of 3.9509 indicates that 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid. Following Lipinski's Rule of Five, 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid has 3 hydrogen bond donor(s) and 4 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 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid?
The CAS number of 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid is 313482-91-6.
What is the molecular formula of 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid?
The molecular formula of 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid is C19H14N2O4S.
What is the molecular weight of 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid?
The molecular weight of 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid is 366.07 g/mol.
Where can I buy 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid?
You can request a quote for 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[3-(2-Thienylcarbonylamino)phenyl]carbonylamino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.