AF-399/42048126
TL;DR: AF-399/42048126 (CAS 620118-11-8) is a chemical compound with molecular formula C27H28N2O5 and molecular weight 460.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(dimethylamino)ethyl]-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one
Also Known As: AF-399/42048126, 1-[2-(Dimethylamino)ethyl]-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one, 1-(2-dimethylaminoethyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one, 5-[3-(benzyloxy)phenyl]-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(5-methyl-2-furoyl)-1,5-dihydro-2H-pyrrol-2-one, 5-[3-(benzyloxy)phenyl]-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-[(5-methylfuran-2-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C27H28N2O5 |
|---|---|
| Molecular Weight | 460.20 g/mol |
| LogP | 4.30692 |
| Topological Polar Surface Area | 83.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 460.19983 |
| Heavy Atoms | 34 |
| Complexity | 1212.5231 |
Chemical Identifiers
| CAS Number | 620118-11-8 |
|---|---|
| SMILES | CC1=CC=C(O1)C(=O)C2=C(C(=O)N(C2C3=CC(=CC=C3)OCC4=CC=CC=C4)CCN(C)C)O |
Product Overview
AF-399/42048126 (CAS 620118-11-8), with molecular formula C27H28N2O5 and molecular weight 460.20 g/mol. IUPAC: 1-[2-(dimethylamino)ethyl]-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one.
Chemical Property Profile of AF-399/42048126
Property Insights of AF-399/42048126
The XLogP value of 4.30692 indicates that AF-399/42048126 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42048126. Following Lipinski's Rule of Five, AF-399/42048126 has 1 hydrogen bond donor(s) and 6 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 AF-399/42048126?
The CAS number of AF-399/42048126 is 620118-11-8.
What is the molecular formula of AF-399/42048126?
The molecular formula of AF-399/42048126 is C27H28N2O5.
What is the molecular weight of AF-399/42048126?
The molecular weight of AF-399/42048126 is 460.20 g/mol.
Where can I buy AF-399/42048126?
You can request a quote for AF-399/42048126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42048126?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42048126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.