AF-399/42176949
TL;DR: AF-399/42176949 (CAS 1005069-03-3) is a chemical compound with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(3,3-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carbonyl)amino]phenyl]-3,3-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxamide
Also Known As: AF-399/42176949, F1716-0069, N-(4-{[(3,3-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)carbonyl]amino}phenyl)-3,3-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxamide, N-[4-[(2,2-dimethyl-3-oxobicyclo[2.2.1]heptane-4-carbonyl)amino]phenyl]-2,2-dimethyl-3-oxobicyclo[2.2.1]heptane-4-carboxamide, N,N'-(1,4-phenylene)bis(3,3-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxamide)
| Molecular Formula | C26H32N2O4 |
|---|---|
| Molecular Weight | 436.24 g/mol |
| LogP | 4.3544 |
| Topological Polar Surface Area | 92.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.2362 |
| Heavy Atoms | 32 |
| Complexity | 957.41156 |
Chemical Identifiers
| CAS Number | 1005069-03-3 |
|---|---|
| SMILES | CC1(C2CCC(C2)(C1=O)C(=O)NC3=CC=C(C=C3)NC(=O)C45CCC(C4)C(C5=O)(C)C)C |
Product Overview
AF-399/42176949 (CAS 1005069-03-3), with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol. IUPAC: N-[4-[(3,3-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carbonyl)amino]phenyl]-3,3-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxamide.
Chemical Property Profile of AF-399/42176949
Property Insights of AF-399/42176949
The XLogP value of 4.3544 indicates that AF-399/42176949 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42176949. Following Lipinski's Rule of Five, AF-399/42176949 has 2 hydrogen bond donor(s) and 4 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-399/42176949?
The CAS number of AF-399/42176949 is 1005069-03-3.
What is the molecular formula of AF-399/42176949?
The molecular formula of AF-399/42176949 is C26H32N2O4.
What is the molecular weight of AF-399/42176949?
The molecular weight of AF-399/42176949 is 436.24 g/mol.
Where can I buy AF-399/42176949?
You can request a quote for AF-399/42176949 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42176949?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42176949 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.