AS-871/42017002
TL;DR: AS-871/42017002 (CAS 578699-20-4) is a chemical compound with molecular formula C23H22N2O6 and molecular weight 422.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one
Also Known As: AS-871/42017002, 2H-Pyrrol-2-one,4-(2-benzofuranylcarbonyl)-5-(2-furanyl)-1,5-dihydro-3-hydroxy-1-[2-(4-morpholinyl)ethyl]-(9CI), 3-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one, 4-(1-benzofuran-2-ylcarbonyl)-5-(2-furyl)-3-hydroxy-1-[2-(4-morpholinyl)ethyl]-1,5-dihydro-2H-pyrrol-2-one, 4-(1-benzofuran-2-ylcarbonyl)-5-(furan-2-yl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C23H22N2O6 |
|---|---|
| Molecular Weight | 422.15 g/mol |
| LogP | 2.9363 |
| Topological Polar Surface Area | 96.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.1478 |
| Heavy Atoms | 31 |
| Complexity | 1107.0027 |
Chemical Identifiers
| CAS Number | 578699-20-4 |
|---|---|
| SMILES | C1COCCN1CCN2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=CO5 |
Product Overview
AS-871/42017002 (CAS 578699-20-4), with molecular formula C23H22N2O6 and molecular weight 422.15 g/mol. IUPAC: 3-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one.
Chemical Property Profile of AS-871/42017002
Property Insights of AS-871/42017002
The XLogP value of 2.9363 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/42017002. The TPSA of 96.36 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/42017002. Following Lipinski's Rule of Five, AS-871/42017002 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 AS-871/42017002?
The CAS number of AS-871/42017002 is 578699-20-4.
What is the molecular formula of AS-871/42017002?
The molecular formula of AS-871/42017002 is C23H22N2O6.
What is the molecular weight of AS-871/42017002?
The molecular weight of AS-871/42017002 is 422.15 g/mol.
Where can I buy AS-871/42017002?
You can request a quote for AS-871/42017002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42017002?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42017002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.