AS-871/41493534
TL;DR: AS-871/41493534 (CAS 381698-36-8) is a chemical compound with molecular formula C24H19N3O7S and molecular weight 493.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3E)-3-[hydroxy(phenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: AS-871/41493534, ethyl 2-[(3E)-3-[hydroxy(phenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate, ethyl 2-(3-benzoyl-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate, ethyl 2-(3-benzoyl-4-hydroxy-2-{4-nitrophenyl}-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate, ethyl 2-[3-hydroxy-5-(4-nitrophenyl)-2-oxo-4-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C24H19N3O7S |
|---|---|
| Molecular Weight | 493.09 g/mol |
| LogP | 4.16272 |
| Topological Polar Surface Area | 139.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.09436 |
| Heavy Atoms | 35 |
| Complexity | 1363.5144 |
Chemical Identifiers
| CAS Number | 381698-36-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)N2C(/C(=C(/C3=CC=CC=C3)\O)/C(=O)C2=O)C4=CC=C(C=C4)[N+](=O)[O-])C |
Product Overview
AS-871/41493534 (CAS 381698-36-8), with molecular formula C24H19N3O7S and molecular weight 493.09 g/mol. IUPAC: ethyl 2-[(3E)-3-[hydroxy(phenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of AS-871/41493534
Property Insights of AS-871/41493534
The XLogP value of 4.16272 indicates that AS-871/41493534 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/41493534. Following Lipinski's Rule of Five, AS-871/41493534 has 1 hydrogen bond donor(s) and 9 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 AS-871/41493534?
The CAS number of AS-871/41493534 is 381698-36-8.
What is the molecular formula of AS-871/41493534?
The molecular formula of AS-871/41493534 is C24H19N3O7S.
What is the molecular weight of AS-871/41493534?
The molecular weight of AS-871/41493534 is 493.09 g/mol.
Where can I buy AS-871/41493534?
You can request a quote for AS-871/41493534 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/41493534?
Yes, KEHONG BIO provides custom synthesis services for AS-871/41493534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.