[4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate
TL;DR: [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate (CAS 1024501-60-7) is a chemical compound with molecular formula C30H30N2O8 and molecular weight 546.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate
Also Known As: [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate|4-(4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)hexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)-2,6-dimethoxyphenyl acetate|4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl acetate
| Molecular Formula | C30H30N2O8 |
|---|---|
| Molecular Weight | 546.20 g/mol |
| LogP | 4.469 |
| Topological Polar Surface Area | 103.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 546.2002 |
| Heavy Atoms | 40 |
| Complexity | 1383.961 |
Chemical Identifiers
| CAS Number | 1024501-60-7 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC(=C(C(=C5)OC)OC(=O)C)OC |
Product Overview
[4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate (CAS 1024501-60-7), with molecular formula C30H30N2O8 and molecular weight 546.20 g/mol. IUPAC: [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate.
Chemical Property Profile of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate
Property Insights of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate
The XLogP value of 4.469 indicates that [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.84 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate. Following Lipinski's Rule of Five, [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate?
The CAS number of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate is 1024501-60-7.
What is the molecular formula of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate?
The molecular formula of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate is C30H30N2O8.
What is the molecular weight of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate?
The molecular weight of [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate is 546.20 g/mol.
Where can I buy [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate?
You can request a quote for [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.