AF-399/41493160
TL;DR: AF-399/41493160 (CAS 519013-17-3) is a chemical compound with molecular formula C23H25FN2O6S and molecular weight 476.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-[2-(2-fluorophenyl)-1-(3-methoxypropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-N,N-dimethylbenzenesulfonamide
Also Known As: AF-399/41493160, 4-[(E)-[2-(2-fluorophenyl)-1-(3-methoxypropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-N,N-dimethylbenzenesulfonamide, 4-{[2-(2-fluorophenyl)-4-hydroxy-1-(3-methoxypropyl)-5-oxo-2,5-dihydro-1H-pyrrol-3-yl]carbonyl}-N,N-dimethylbenzenesulfonamide, 4-(2-(2-fluorophenyl)-4-hydroxy-1-(3-methoxypropyl)-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl)-N,N-dimethylbenzenesulfonamide, 4-[(E)-[2-(2-fluorophenyl)-1-(3-methoxypropyl)-4,5-dioxopyrrolidin-3-ylidene](hydroxy)methyl]-N,N-dimethylbenzenesulfonamide
| Molecular Formula | C23H25FN2O6S |
|---|---|
| Molecular Weight | 476.14 g/mol |
| LogP | 2.5342 |
| Topological Polar Surface Area | 104.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.14172 |
| Heavy Atoms | 33 |
| Complexity | 1191.6873 |
Chemical Identifiers
| CAS Number | 519013-17-3 |
|---|---|
| SMILES | CN(C)S(=O)(=O)C1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCOC)C3=CC=CC=C3F)/O |
Product Overview
AF-399/41493160 (CAS 519013-17-3), with molecular formula C23H25FN2O6S and molecular weight 476.14 g/mol. IUPAC: 4-[(E)-[2-(2-fluorophenyl)-1-(3-methoxypropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-N,N-dimethylbenzenesulfonamide.
Chemical Property Profile of AF-399/41493160
Property Insights of AF-399/41493160
The XLogP value of 2.5342 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/41493160. The TPSA of 104.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41493160. Following Lipinski's Rule of Five, AF-399/41493160 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-399/41493160?
The CAS number of AF-399/41493160 is 519013-17-3.
What is the molecular formula of AF-399/41493160?
The molecular formula of AF-399/41493160 is C23H25FN2O6S.
What is the molecular weight of AF-399/41493160?
The molecular weight of AF-399/41493160 is 476.14 g/mol.
Where can I buy AF-399/41493160?
You can request a quote for AF-399/41493160 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41493160?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41493160 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.