![2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid structure](/static/products/102/1024189-51-2.png)
2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid
TL;DR: 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid (CAS 1024189-51-2) is a chemical compound with molecular formula C27H24N2O7 and molecular weight 488.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid
Also Known As: 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid, 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid, 6-(4,6-dioxo-2-phenyl-5-(m-tolyl)hexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)-2,3-dimethoxybenzoic acid
| Molecular Formula | C27H24N2O7 |
|---|---|
| Molecular Weight | 488.16 g/mol |
| LogP | 3.76152 |
| Topological Polar Surface Area | 105.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 488.15836 |
| Heavy Atoms | 36 |
| Complexity | 1357.483 |
Chemical Identifiers
| CAS Number | 1024189-51-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=C(C(=C(C=C5)OC)OC)C(=O)O |
Product Overview
2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid (CAS 1024189-51-2), with molecular formula C27H24N2O7 and molecular weight 488.16 g/mol. IUPAC: 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid.
Chemical Property Profile of 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid
Property Insights of 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid
The XLogP value of 3.76152 indicates that 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid. Following Lipinski's Rule of Five, 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid has 1 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 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid?
The CAS number of 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid is 1024189-51-2.
What is the molecular formula of 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid?
The molecular formula of 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid is C27H24N2O7.
What is the molecular weight of 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid?
The molecular weight of 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid is 488.16 g/mol.
Where can I buy 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid?
You can request a quote for 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3-dimethoxy-6-[5-(3-methylphenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.