AF-399/41725726
TL;DR: AF-399/41725726 (CAS 608106-55-4) is a chemical compound with molecular formula C25H34N6O3 and molecular weight 466.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-11-methyl-N-(3-morpholin-4-ylpropyl)-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AF-399/41725726, 6-imino-11-methyl-N-[3-(morpholin-4-yl)propyl]-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide, 2-imino-10-methyl-N-[3-(4-morpholinyl)propyl]-5-oxo-1-pentyl-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, 2-imino-10-methyl-N-[3-(morpholin-4-yl)propyl]-5-oxo-1-pentyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C25H34N6O3 |
|---|---|
| Molecular Weight | 466.27 g/mol |
| LogP | 2.07939 |
| Topological Polar Surface Area | 104.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 466.26923 |
| Heavy Atoms | 34 |
| Complexity | 1289.7688 |
Chemical Identifiers
| CAS Number | 608106-55-4 |
|---|---|
| SMILES | CCCCCN1C2=C(C=C(C1=N)C(=O)NCCCN3CCOCC3)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
AF-399/41725726 (CAS 608106-55-4), with molecular formula C25H34N6O3 and molecular weight 466.27 g/mol. IUPAC: 6-imino-11-methyl-N-(3-morpholin-4-ylpropyl)-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of AF-399/41725726
Property Insights of AF-399/41725726
The XLogP value of 2.07939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/41725726. The TPSA of 104.72 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41725726. Following Lipinski's Rule of Five, AF-399/41725726 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-399/41725726?
The CAS number of AF-399/41725726 is 608106-55-4.
What is the molecular formula of AF-399/41725726?
The molecular formula of AF-399/41725726 is C25H34N6O3.
What is the molecular weight of AF-399/41725726?
The molecular weight of AF-399/41725726 is 466.27 g/mol.
Where can I buy AF-399/41725726?
You can request a quote for AF-399/41725726 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41725726?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41725726 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.