![4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid structure](/static/products/7318/731826-95-2.webp)
4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid
TL;DR: 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid (CAS 731826-95-2) is a chemical compound with molecular formula C17H12N4O3 and molecular weight 320.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino]benzoic acid
Also Known As: 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid, 4-{[5-(3H-indol-3-ylidene)-4,5-dihydro-1,3,4-oxadiazol-2-yl]amino}benzoic acid, 4-((5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl)amino)benzoic acid, 4-([5-(3H-INDOL-3-YLIDENE)-4,5-DIHYDRO-1,3,4-OXADIAZOL-2-YL]AMINO)BENZOIC ACID, 4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)amino]benzoic acid
| Molecular Formula | C17H12N4O3 |
|---|---|
| Molecular Weight | 320.09 g/mol |
| LogP | 3.6597 |
| Topological Polar Surface Area | 104.04 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.09094 |
| Heavy Atoms | 24 |
| Complexity | 1017.6912 |
Chemical Identifiers
| CAS Number | 731826-95-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C3=NN=C(O3)NC4=CC=C(C=C4)C(=O)O |
Product Overview
4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid (CAS 731826-95-2), with molecular formula C17H12N4O3 and molecular weight 320.09 g/mol. IUPAC: 4-[[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino]benzoic acid.
Chemical Property Profile of 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid
Property Insights of 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid
The XLogP value of 3.6597 indicates that 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid has 3 hydrogen bond donor(s) and 5 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-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid?
The CAS number of 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid is 731826-95-2.
What is the molecular formula of 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid?
The molecular formula of 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid is C17H12N4O3.
What is the molecular weight of 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid?
The molecular weight of 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid is 320.09 g/mol.
Where can I buy 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid?
You can request a quote for 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]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-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.