AO-022/41725120
TL;DR: AO-022/41725120 (CAS 587012-81-5) is a chemical compound with molecular formula C26H23N5O3 and molecular weight 453.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-6-imino-11-methyl-7-[(4-methylphenyl)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-022/41725120, N-(Furan-2-ylmethyl)-6-imino-11-methyl-7-[(4-methylphenyl)methyl]-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide, N-(2-FURYLMETHYL)-2-IMINO-10-METHYL-1-(4-METHYLBENZYL)-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2',3'-D]PYRIMIDINE-3-CARBOXAMIDE, N-(2-furylmethyl)-2-imino-10-methyl-1-(4-methylbenzyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, N-(furan-2-ylmethyl)-2-imino-10-methyl-1-(4-methylbenzyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C26H23N5O3 |
|---|---|
| Molecular Weight | 453.18 g/mol |
| LogP | 3.31681 |
| Topological Polar Surface Area | 105.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.18008 |
| Heavy Atoms | 34 |
| Complexity | 1645.3132 |
Chemical Identifiers
| CAS Number | 587012-81-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=C(C=C(C2=N)C(=O)NCC4=CC=CO4)C(=O)N5C=CC=C(C5=N3)C |
Product Overview
AO-022/41725120 (CAS 587012-81-5), with molecular formula C26H23N5O3 and molecular weight 453.18 g/mol. IUPAC: N-(furan-2-ylmethyl)-6-imino-11-methyl-7-[(4-methylphenyl)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-022/41725120
Property Insights of AO-022/41725120
The XLogP value of 3.31681 indicates that AO-022/41725120 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.39 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/41725120. Following Lipinski's Rule of Five, AO-022/41725120 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 AO-022/41725120?
The CAS number of AO-022/41725120 is 587012-81-5.
What is the molecular formula of AO-022/41725120?
The molecular formula of AO-022/41725120 is C26H23N5O3.
What is the molecular weight of AO-022/41725120?
The molecular weight of AO-022/41725120 is 453.18 g/mol.
Where can I buy AO-022/41725120?
You can request a quote for AO-022/41725120 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/41725120?
Yes, KEHONG BIO provides custom synthesis services for AO-022/41725120 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.