AF-794/00086051
TL;DR: AF-794/00086051 (CAS 114328-56-2) is a chemical compound with molecular formula C10H8ClNO3 and molecular weight 225.01927 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-4-(4-chloroanilino)-4-oxobut-2-enoic acid
Also Known As: N-(4-Chlorophenyl)Maleamic Acid, N- MALEAMICACID, N-(p-chlorophenyl)maleamic acid, n-(4-chlorophenyl) maleamic acid, N-(4-Chlorophenyl)maleamidic acid
Technical Specifications
| Molecular Formula | C10H8ClNO3 |
| Molecular Weight | 225.01927 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.01927 Da |
| Heavy Atoms | 15 |
| Complexity | 270.0 |
| SMILES | C1=CC(=CC=C1NC(=O)/C=C\C(=O)O)Cl |
| InChIKey | FBTQVXSNFILAQY-WAYWQWQTSA-N |
Chemical Property Profile of AF-794/00086051
Property Insights of AF-794/00086051
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-794/00086051. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-794/00086051. Following Lipinski's Rule of Five, AF-794/00086051 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AF-794/00086051?
The CAS number of AF-794/00086051 is 114328-56-2.
What is the molecular formula of AF-794/00086051?
The molecular formula of AF-794/00086051 is C10H8ClNO3.
What is the molecular weight of AF-794/00086051?
The molecular weight of AF-794/00086051 is 225.01927 g/mol.
Where can I buy AF-794/00086051?
You can request a quote for AF-794/00086051 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AF-794/00086051?
Yes, CoreyChem provides custom synthesis services for AF-794/00086051 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.