5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid
TL;DR: 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid (CAS 897798-71-9) is a chemical compound with molecular formula C20H13N3O7 and molecular weight 407.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid
Also Known As: 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid, 5-hydroxy-2-(2-(5-methylisoxazol-3-yl)-1,3-dioxoisoindoline-5-carboxamido)benzoic acid, 2-[[1,3-diketo-2-(5-methylisoxazol-3-yl)isoindoline-5-carbonyl]amino]-5-hydroxy-benzoic acid, 2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-5-oxidanyl-benzoic acid, 5-hydroxy-2-({[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)benzoic acid
| Molecular Formula | C20H13N3O7 |
|---|---|
| Molecular Weight | 407.08 g/mol |
| LogP | 2.43972 |
| Topological Polar Surface Area | 150.04 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.07535 |
| Heavy Atoms | 30 |
| Complexity | 1244.9471 |
Chemical Identifiers
| CAS Number | 897798-71-9 |
|---|---|
| SMILES | CC1=CC(=NO1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=C(C=C4)O)C(=O)O |
Product Overview
5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid (CAS 897798-71-9), with molecular formula C20H13N3O7 and molecular weight 407.08 g/mol. IUPAC: 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid.
Chemical Property Profile of 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid
Property Insights of 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid
The XLogP value of 2.43972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid. The TPSA of 150.04 Ų indicates high polarity, suggesting 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid has 3 hydrogen bond donor(s) and 7 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 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid?
The CAS number of 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid is 897798-71-9.
What is the molecular formula of 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid?
The molecular formula of 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid is C20H13N3O7.
What is the molecular weight of 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid?
The molecular weight of 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid is 407.08 g/mol.
Where can I buy 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid?
You can request a quote for 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-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 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-hydroxy-2-[[2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.