AJ-030/14523056
TL;DR: AJ-030/14523056 (CAS 444793-50-4) is a chemical compound with molecular formula C19H17Cl2N3O4 and molecular weight 421.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,4-dichlorophenyl)iminomethyl]-1-(furan-2-ylmethyl)-6-hydroxy-3-propan-2-ylpyrimidine-2,4-dione
Also Known As: AJ-030/14523056, 5-[(2,4-dichloroanilino)methylene]-1-(2-furylmethyl)-3-isopropyl-2,4,6(1H,3H,5H)-pyrimidinetrione, (5E)-5-[(2,4-dichloroanilino)methylidene]-1-(furan-2-ylmethyl)-3-propan-2-yl-1,3-diazinane-2,4,6-trione, 5-[(2,4-dichloroanilino)methylidene]-1-(furan-2-ylmethyl)-3-propan-2-yl-1,3-diazinane-2,4,6-trione, 5-[(2,4-dichlorophenyl)iminomethyl]-1-(furan-2-ylmethyl)-6-hydroxy-3-propan-2-ylpyrimidine-2,4-dione
| Molecular Formula | C19H17Cl2N3O4 |
|---|---|
| Molecular Weight | 421.06 g/mol |
| LogP | 3.9952 |
| Topological Polar Surface Area | 89.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.0596 |
| Heavy Atoms | 28 |
| Complexity | 1145.216 |
Chemical Identifiers
| CAS Number | 444793-50-4 |
|---|---|
| SMILES | CC(C)N1C(=O)C(=C(N(C1=O)CC2=CC=CO2)O)C=NC3=C(C=C(C=C3)Cl)Cl |
Product Overview
AJ-030/14523056 (CAS 444793-50-4), with molecular formula C19H17Cl2N3O4 and molecular weight 421.06 g/mol. IUPAC: 5-[(2,4-dichlorophenyl)iminomethyl]-1-(furan-2-ylmethyl)-6-hydroxy-3-propan-2-ylpyrimidine-2,4-dione.
Chemical Property Profile of AJ-030/14523056
Property Insights of AJ-030/14523056
The XLogP value of 3.9952 indicates that AJ-030/14523056 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.73 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-030/14523056. Following Lipinski's Rule of Five, AJ-030/14523056 has 1 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 AJ-030/14523056?
The CAS number of AJ-030/14523056 is 444793-50-4.
What is the molecular formula of AJ-030/14523056?
The molecular formula of AJ-030/14523056 is C19H17Cl2N3O4.
What is the molecular weight of AJ-030/14523056?
The molecular weight of AJ-030/14523056 is 421.06 g/mol.
Where can I buy AJ-030/14523056?
You can request a quote for AJ-030/14523056 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-030/14523056?
Yes, KEHONG BIO provides custom synthesis services for AJ-030/14523056 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.