AF-399/13806269
TL;DR: AF-399/13806269 (CAS 314074-01-6) is a chemical compound with molecular formula C16H20N4O4 and molecular weight 332.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-3-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)propanamide
Also Known As: AF-399/13806269, N'-(2,4-dimethoxybenzylidene)-3-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl)propanohydrazide, N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-3-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl)propanohydrazide
| Molecular Formula | C16H20N4O4 |
|---|---|
| Molecular Weight | 332.15 g/mol |
| LogP | 1.056 |
| Topological Polar Surface Area | 101.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 332.14847 |
| Heavy Atoms | 24 |
| Complexity | 684.655 |
Chemical Identifiers
| CAS Number | 314074-01-6 |
|---|---|
| SMILES | CC1=NNC(=O)C1CCC(=O)N/N=C/C2=C(C=C(C=C2)OC)OC |
Product Overview
AF-399/13806269 (CAS 314074-01-6), with molecular formula C16H20N4O4 and molecular weight 332.15 g/mol. IUPAC: N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-3-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)propanamide.
Chemical Property Profile of AF-399/13806269
Property Insights of AF-399/13806269
The XLogP value of 1.056 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/13806269. The TPSA of 101.38 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/13806269. Following Lipinski's Rule of Five, AF-399/13806269 has 2 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-399/13806269?
The CAS number of AF-399/13806269 is 314074-01-6.
What is the molecular formula of AF-399/13806269?
The molecular formula of AF-399/13806269 is C16H20N4O4.
What is the molecular weight of AF-399/13806269?
The molecular weight of AF-399/13806269 is 332.15 g/mol.
Where can I buy AF-399/13806269?
You can request a quote for AF-399/13806269 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/13806269?
Yes, KEHONG BIO provides custom synthesis services for AF-399/13806269 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.