AF-399/41725695
TL;DR: AF-399/41725695 (CAS 608105-83-5) is a chemical compound with molecular formula C21H27N5O3 and molecular weight 397.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-butyl-N-(3-ethoxypropyl)-6-imino-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-399/41725695, 7-Butyl-N-(3-ethoxypropyl)-6-imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide, 1-butyl-N-(3-ethoxypropyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 1-butyl-N-(3-ethoxypropyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
| Molecular Formula | C21H27N5O3 |
|---|---|
| Molecular Weight | 397.21 g/mol |
| LogP | 2.08517 |
| Topological Polar Surface Area | 101.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 397.2114 |
| Heavy Atoms | 29 |
| Complexity | 1132.7999 |
Chemical Identifiers
| CAS Number | 608105-83-5 |
|---|---|
| SMILES | CCCCN1C2=C(C=C(C1=N)C(=O)NCCCOCC)C(=O)N3C=CC=CC3=N2 |
Product Overview
AF-399/41725695 (CAS 608105-83-5), with molecular formula C21H27N5O3 and molecular weight 397.21 g/mol. IUPAC: 7-butyl-N-(3-ethoxypropyl)-6-imino-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-399/41725695
Property Insights of AF-399/41725695
The XLogP value of 2.08517 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/41725695. The TPSA of 101.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41725695. Following Lipinski's Rule of Five, AF-399/41725695 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-399/41725695?
The CAS number of AF-399/41725695 is 608105-83-5.
What is the molecular formula of AF-399/41725695?
The molecular formula of AF-399/41725695 is C21H27N5O3.
What is the molecular weight of AF-399/41725695?
The molecular weight of AF-399/41725695 is 397.21 g/mol.
Where can I buy AF-399/41725695?
You can request a quote for AF-399/41725695 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41725695?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41725695 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.