AS-871/41202736
TL;DR: AS-871/41202736 (CAS 1005052-92-5) is a chemical compound with molecular formula C25H22N2O6 and molecular weight 446.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(furan-2-yl)-2-(2-methylphenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Also Known As: AS-871/41202736, ethyl 4-[3-(furan-2-yl)-2-(2-methylphenyl)-4,6-dioxo-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate, F3115-0012, ethyl 4-[3-(2-furyl)-2-(2-methylphenyl)-4,6-dioxohexahydro-5H-pyrrolo[3,4-d]isoxazol-5-yl]benzoate, ethyl 4-[3-(furan-2-yl)-2-(2-methylphenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
| Molecular Formula | C25H22N2O6 |
|---|---|
| Molecular Weight | 446.15 g/mol |
| LogP | 3.81582 |
| Topological Polar Surface Area | 89.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.1478 |
| Heavy Atoms | 33 |
| Complexity | 1203.8998 |
Chemical Identifiers
| CAS Number | 1005052-92-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4C)C5=CC=CO5 |
Product Overview
AS-871/41202736 (CAS 1005052-92-5), with molecular formula C25H22N2O6 and molecular weight 446.15 g/mol. IUPAC: ethyl 4-[3-(furan-2-yl)-2-(2-methylphenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate.
Chemical Property Profile of AS-871/41202736
Property Insights of AS-871/41202736
The XLogP value of 3.81582 indicates that AS-871/41202736 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/41202736. Following Lipinski's Rule of Five, AS-871/41202736 has 0 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 AS-871/41202736?
The CAS number of AS-871/41202736 is 1005052-92-5.
What is the molecular formula of AS-871/41202736?
The molecular formula of AS-871/41202736 is C25H22N2O6.
What is the molecular weight of AS-871/41202736?
The molecular weight of AS-871/41202736 is 446.15 g/mol.
Where can I buy AS-871/41202736?
You can request a quote for AS-871/41202736 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/41202736?
Yes, KEHONG BIO provides custom synthesis services for AS-871/41202736 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.