AO-022/43454532
TL;DR: AO-022/43454532 (CAS 848753-98-0) is a chemical compound with molecular formula C25H27N5O4 and molecular weight 461.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-N-[(4-methoxyphenyl)methyl]-7-(3-methoxypropyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AO-022/43454532, 2-imino-N-(4-methoxybenzyl)-1-(3-methoxypropyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, 2-imino-N-(4-methoxybenzyl)-1-(3-methoxypropyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 6-Imino-N-[(4-methoxyphenyl)methyl]-7-(3-methoxypropyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide, 2-imino-N-(4-methoxybenzyl)-1-(3-methoxypropyl)-10-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C25H27N5O4 |
|---|---|
| Molecular Weight | 461.21 g/mol |
| LogP | 2.41219 |
| Topological Polar Surface Area | 110.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 461.2063 |
| Heavy Atoms | 34 |
| Complexity | 1471.6852 |
Chemical Identifiers
| CAS Number | 848753-98-0 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CCCOC)C(=O)NCC4=CC=C(C=C4)OC |
Product Overview
AO-022/43454532 (CAS 848753-98-0), with molecular formula C25H27N5O4 and molecular weight 461.21 g/mol. IUPAC: 6-imino-N-[(4-methoxyphenyl)methyl]-7-(3-methoxypropyl)-11-methyl-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 AO-022/43454532
Property Insights of AO-022/43454532
The XLogP value of 2.41219 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-022/43454532. The TPSA of 110.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454532. Following Lipinski's Rule of Five, AO-022/43454532 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 AO-022/43454532?
The CAS number of AO-022/43454532 is 848753-98-0.
What is the molecular formula of AO-022/43454532?
The molecular formula of AO-022/43454532 is C25H27N5O4.
What is the molecular weight of AO-022/43454532?
The molecular weight of AO-022/43454532 is 461.21 g/mol.
Where can I buy AO-022/43454532?
You can request a quote for AO-022/43454532 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454532?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454532 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.