![2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid structure](/static/products/100/1005082-88-1.png)
2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid
TL;DR: 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid (CAS 1005082-88-1) is a chemical compound with molecular formula C25H20N2O6 and molecular weight 444.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4,6-dioxo-2,5-diphenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl)phenoxy]acetic acid
Also Known As: 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid, [2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl)phenoxy]acetic acid, 2-[2-(4,6-dioxo-2,5-diphenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl)phenoxy]acetic acid
| Molecular Formula | C25H20N2O6 |
|---|---|
| Molecular Weight | 444.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.13214 |
| Heavy Atoms | 33 |
| Complexity | 747.0 |
Chemical Identifiers
| CAS Number | 1005082-88-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5OCC(=O)O |
| InChIKey | QRDNEVXKPVQSKQ-UHFFFAOYSA-N |
Product Overview
2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid (CAS 1005082-88-1), with molecular formula C25H20N2O6 and molecular weight 444.13 g/mol. IUPAC: 2-[2-(4,6-dioxo-2,5-diphenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl)phenoxy]acetic acid.
Chemical Property Profile of 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid
Property Insights of 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid
The XLogP value of 3.6 indicates that 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid. Following Lipinski's Rule of Five, 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic 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-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid?
The CAS number of 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid is 1005082-88-1.
What is the molecular formula of 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid?
The molecular formula of 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid is C25H20N2O6.
What is the molecular weight of 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid?
The molecular weight of 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid is 444.13 g/mol.
Where can I buy 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid?
You can request a quote for 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)phenoxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.