AO-022/43453317
TL;DR: AO-022/43453317 (CAS 844454-27-9) is a chemical compound with molecular formula C23H22FN5O2 and molecular weight 419.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AO-022/43453317, N-[(4-Fluorophenyl)methyl]-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide, N-(4-fluorobenzyl)-2-imino-10-methyl-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, N-(4-fluorobenzyl)-2-imino-10-methyl-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, N-(4-fluorobenzyl)-2-imino-10-methyl-5-oxo-1-propyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C23H22FN5O2 |
|---|---|
| Molecular Weight | 419.18 g/mol |
| LogP | 2.91619 |
| Topological Polar Surface Area | 92.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.17575 |
| Heavy Atoms | 31 |
| Complexity | 1420.8654 |
Chemical Identifiers
| CAS Number | 844454-27-9 |
|---|---|
| SMILES | CCCN1C2=C(C=C(C1=N)C(=O)NCC3=CC=C(C=C3)F)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
AO-022/43453317 (CAS 844454-27-9), with molecular formula C23H22FN5O2 and molecular weight 419.18 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of AO-022/43453317
Property Insights of AO-022/43453317
The XLogP value of 2.91619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-022/43453317. The TPSA of 92.25 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453317. Following Lipinski's Rule of Five, AO-022/43453317 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 AO-022/43453317?
The CAS number of AO-022/43453317 is 844454-27-9.
What is the molecular formula of AO-022/43453317?
The molecular formula of AO-022/43453317 is C23H22FN5O2.
What is the molecular weight of AO-022/43453317?
The molecular weight of AO-022/43453317 is 419.18 g/mol.
Where can I buy AO-022/43453317?
You can request a quote for AO-022/43453317 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453317?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453317 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.