AH-487/41654039
TL;DR: AH-487/41654039 (CAS 1084609-75-5) is a chemical compound with molecular formula C20H17N3O8S and molecular weight 459.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(5E)-5-[[3-methoxy-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate
Also Known As: AH-487/41654039, methyl 2-[(5E)-5-{3-methoxy-4-[(5-nitropyridin-2-yl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate, methyl 2-[(5E)-5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate, (E)-methyl 2-(5-(3-methoxy-4-((5-nitropyridin-2-yl)oxy)benzylidene)-2,4-dioxothiazolidin-3-yl)propanoate, methyl 2-{5-[4-({5-nitro-2-pyridinyl}oxy)-3-methoxybenzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
| Molecular Formula | C20H17N3O8S |
|---|---|
| Molecular Weight | 459.07 g/mol |
| LogP | 3.3885 |
| Topological Polar Surface Area | 138.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 459.07364 |
| Heavy Atoms | 32 |
| Complexity | 1116.328 |
Chemical Identifiers
| CAS Number | 1084609-75-5 |
|---|---|
| SMILES | CC(C(=O)OC)N1C(=O)/C(=C\C2=CC(=C(C=C2)OC3=NC=C(C=C3)[N+](=O)[O-])OC)/SC1=O |
Product Overview
AH-487/41654039 (CAS 1084609-75-5), with molecular formula C20H17N3O8S and molecular weight 459.07 g/mol. IUPAC: methyl 2-[(5E)-5-[[3-methoxy-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate.
Chemical Property Profile of AH-487/41654039
Property Insights of AH-487/41654039
The XLogP value of 3.3885 indicates that AH-487/41654039 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.17 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/41654039. Following Lipinski's Rule of Five, AH-487/41654039 has 0 hydrogen bond donor(s) and 10 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 AH-487/41654039?
The CAS number of AH-487/41654039 is 1084609-75-5.
What is the molecular formula of AH-487/41654039?
The molecular formula of AH-487/41654039 is C20H17N3O8S.
What is the molecular weight of AH-487/41654039?
The molecular weight of AH-487/41654039 is 459.07 g/mol.
Where can I buy AH-487/41654039?
You can request a quote for AH-487/41654039 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/41654039?
Yes, KEHONG BIO provides custom synthesis services for AH-487/41654039 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.