AF-399/41399804
TL;DR: AF-399/41399804 (CAS 617697-67-3) is a chemical compound with molecular formula C25H27N5O2 and molecular weight 429.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-butyl-6-imino-11-methyl-2-oxo-N-(1-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AF-399/41399804, 1-butyl-2-imino-10-methyl-5-oxo-N-(1-phenylethyl)-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, F1423-1372, 1-butyl-2-imino-10-methyl-5-oxo-N-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a, 1-butyl-2-imino-10-methyl-5-oxo-N-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
| Molecular Formula | C25H27N5O2 |
|---|---|
| Molecular Weight | 429.22 g/mol |
| LogP | 3.72819 |
| Topological Polar Surface Area | 92.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.21646 |
| Heavy Atoms | 32 |
| Complexity | 1419.9856 |
Chemical Identifiers
| CAS Number | 617697-67-3 |
|---|---|
| SMILES | CCCCN1C2=C(C=C(C1=N)C(=O)NC(C)C3=CC=CC=C3)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
AF-399/41399804 (CAS 617697-67-3), with molecular formula C25H27N5O2 and molecular weight 429.22 g/mol. IUPAC: 7-butyl-6-imino-11-methyl-2-oxo-N-(1-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of AF-399/41399804
Property Insights of AF-399/41399804
The XLogP value of 3.72819 indicates that AF-399/41399804 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.25 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41399804. Following Lipinski's Rule of Five, AF-399/41399804 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-399/41399804?
The CAS number of AF-399/41399804 is 617697-67-3.
What is the molecular formula of AF-399/41399804?
The molecular formula of AF-399/41399804 is C25H27N5O2.
What is the molecular weight of AF-399/41399804?
The molecular weight of AF-399/41399804 is 429.22 g/mol.
Where can I buy AF-399/41399804?
You can request a quote for AF-399/41399804 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41399804?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41399804 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.