![[4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate structure](/static/products/121/1212078-22-2.webp)
[4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate
TL;DR: [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate (CAS 1212078-22-2) is a chemical compound with molecular formula C21H18N2O7 and molecular weight 410.1114 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate
Also Known As: [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate|4-((3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-6,6a-dihydro-3aH-pyrrolo[3,4-d]isoxazol-5(4H)-yl)phenyl acetate
Technical Specifications
| Molecular Formula | C21H18N2O7 |
| Molecular Weight | 410.1114 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.1114 Da |
| Heavy Atoms | 30 |
| Complexity | 731.0 |
| SMILES | CC(=O)OC1=CC=C(C=C1)N2C(=O)[C@H]3[C@@H](C2=O)ON=C3C4=C(C=C(C=C4)OC)OC |
| InChIKey | SKDZJFOSGXMNNF-MJGOQNOKSA-N |
Chemical Property Profile of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate
Property Insights of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate. Following Lipinski's Rule of Five, [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate?
The CAS number of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate is 1212078-22-2.
What is the molecular formula of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate?
The molecular formula of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate is C21H18N2O7.
What is the molecular weight of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate?
The molecular weight of [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate is 410.1114 g/mol.
Where can I buy [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate?
You can request a quote for [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate?
Yes, CoreyChem provides custom synthesis services for [4-[(3aR,6aS)-3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.