AN-758/13190105
TL;DR: AN-758/13190105 (CAS 354785-81-2) is a chemical compound with molecular formula C26H25N3O8S and molecular weight 539.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AN-758/13190105, ethyl 2-{3-ethoxy-2-hydroxy-5-nitrobenzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-[(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C26H25N3O8S |
|---|---|
| Molecular Weight | 539.14 g/mol |
| LogP | 2.8194 |
| Topological Polar Surface Area | 142.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 539.1362 |
| Heavy Atoms | 38 |
| Complexity | 1619.4841 |
Chemical Identifiers
| CAS Number | 354785-81-2 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1O)/C=C\2/C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=C(C=C4)OC)[N+](=O)[O-] |
Product Overview
AN-758/13190105 (CAS 354785-81-2), with molecular formula C26H25N3O8S and molecular weight 539.14 g/mol. IUPAC: ethyl (2Z)-2-[(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AN-758/13190105
Property Insights of AN-758/13190105
The XLogP value of 2.8194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-758/13190105. The TPSA of 142.49 Ų indicates high polarity, suggesting AN-758/13190105 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AN-758/13190105 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-758/13190105?
The CAS number of AN-758/13190105 is 354785-81-2.
What is the molecular formula of AN-758/13190105?
The molecular formula of AN-758/13190105 is C26H25N3O8S.
What is the molecular weight of AN-758/13190105?
The molecular weight of AN-758/13190105 is 539.14 g/mol.
Where can I buy AN-758/13190105?
You can request a quote for AN-758/13190105 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-758/13190105?
Yes, KEHONG BIO provides custom synthesis services for AN-758/13190105 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.