AF-399/40862726
TL;DR: AF-399/40862726 (CAS 1212444-85-3) is a chemical compound with molecular formula C20H21N3O3 and molecular weight 351.1583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,7,7-trimethyl-3-oxo-N,N-dipyridin-2-yl-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Also Known As: AF-399/40862726, N,N-di(2-pyridyl)(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptyl)carboxamide, 4,7,7-trimethyl-3-oxo-N,N-di(pyridin-2-yl)-2-oxabicyclo[2.2.1]heptane-1-carboxamide, 1,7,7-trimethyl-2-oxo-N,N-dipyridin-2-yl-3-oxabicyclo[2.2.1]heptane-4-carboxamide, 4,7,7-trimethyl-3-oxo-N,N-di(2-pyridinyl)-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Technical Specifications
| Molecular Formula | C20H21N3O3 |
| Molecular Weight | 351.1583 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 72.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.1583 Da |
| Heavy Atoms | 26 |
| Complexity | 589.0 |
| SMILES | CC1(C2(CCC1(OC2=O)C(=O)N(C3=CC=CC=N3)C4=CC=CC=N4)C)C |
| InChIKey | XWARXXMNZVNGJV-UHFFFAOYSA-N |
Chemical Property Profile of AF-399/40862726
Property Insights of AF-399/40862726
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/40862726. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40862726. Following Lipinski's Rule of Five, AF-399/40862726 has 0 hydrogen bond donor(s) and 5 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-399/40862726?
The CAS number of AF-399/40862726 is 1212444-85-3.
What is the molecular formula of AF-399/40862726?
The molecular formula of AF-399/40862726 is C20H21N3O3.
What is the molecular weight of AF-399/40862726?
The molecular weight of AF-399/40862726 is 351.1583 g/mol.
Where can I buy AF-399/40862726?
You can request a quote for AF-399/40862726 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AF-399/40862726?
Yes, CoreyChem provides custom synthesis services for AF-399/40862726 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.