AF-399/42864269
TL;DR: AF-399/42864269 (CAS 720672-45-7) is a chemical compound with molecular formula C23H23N5O3 and molecular weight 417.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-N-(3-methoxyphenyl)-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AF-399/42864269, AB00615465-02, F1673-5798, 2-imino-1-isobutyl-N-(3-methoxyphenyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, 6-imino-N-(3-methoxyphenyl)-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
| Molecular Formula | C23H23N5O3 |
|---|---|
| Molecular Weight | 417.18 g/mol |
| LogP | 3.04557 |
| Topological Polar Surface Area | 101.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.18008 |
| Heavy Atoms | 31 |
| Complexity | 1418.6737 |
Chemical Identifiers
| CAS Number | 720672-45-7 |
|---|---|
| SMILES | CC(C)CN1C2=C(C=C(C1=N)C(=O)NC3=CC(=CC=C3)OC)C(=O)N4C=CC=CC4=N2 |
Product Overview
AF-399/42864269 (CAS 720672-45-7), with molecular formula C23H23N5O3 and molecular weight 417.18 g/mol. IUPAC: 6-imino-N-(3-methoxyphenyl)-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of AF-399/42864269
Property Insights of AF-399/42864269
The XLogP value of 3.04557 indicates that AF-399/42864269 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42864269. Following Lipinski's Rule of Five, AF-399/42864269 has 2 hydrogen bond donor(s) and 5 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-399/42864269?
The CAS number of AF-399/42864269 is 720672-45-7.
What is the molecular formula of AF-399/42864269?
The molecular formula of AF-399/42864269 is C23H23N5O3.
What is the molecular weight of AF-399/42864269?
The molecular weight of AF-399/42864269 is 417.18 g/mol.
Where can I buy AF-399/42864269?
You can request a quote for AF-399/42864269 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42864269?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42864269 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.