AQ-090/41698516
TL;DR: AQ-090/41698516 (CAS 638995-67-2) is a chemical compound with molecular formula C25H28N2O7 and molecular weight 468.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[(2-ethoxycarbonylphenoxy)methyl]-4-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: AQ-090/41698516, ethyl 4-(3-{[2-(ethoxycarbonyl)phenoxy]methyl}-4-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, ethyl 4-[3-[(2-ethoxycarbonylphenoxy)methyl]-4-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, ethyl 4-(3-((2-(ethoxycarbonyl)phenoxy)methyl)-4-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C25H28N2O7 |
|---|---|
| Molecular Weight | 468.19 g/mol |
| LogP | 3.6419 |
| Topological Polar Surface Area | 112.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 468.18964 |
| Heavy Atoms | 34 |
| Complexity | 1110.193 |
Chemical Identifiers
| CAS Number | 638995-67-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1OCC2=C(C=CC(=C2)C3C(=C(NC(=O)N3)C)C(=O)OCC)OC |
Product Overview
AQ-090/41698516 (CAS 638995-67-2), with molecular formula C25H28N2O7 and molecular weight 468.19 g/mol. IUPAC: ethyl 4-[3-[(2-ethoxycarbonylphenoxy)methyl]-4-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of AQ-090/41698516
Property Insights of AQ-090/41698516
The XLogP value of 3.6419 indicates that AQ-090/41698516 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-090/41698516. Following Lipinski's Rule of Five, AQ-090/41698516 has 2 hydrogen bond donor(s) and 7 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 AQ-090/41698516?
The CAS number of AQ-090/41698516 is 638995-67-2.
What is the molecular formula of AQ-090/41698516?
The molecular formula of AQ-090/41698516 is C25H28N2O7.
What is the molecular weight of AQ-090/41698516?
The molecular weight of AQ-090/41698516 is 468.19 g/mol.
Where can I buy AQ-090/41698516?
You can request a quote for AQ-090/41698516 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-090/41698516?
Yes, KEHONG BIO provides custom synthesis services for AQ-090/41698516 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.