AS-871/41502270
TL;DR: AS-871/41502270 (CAS 380554-17-6) is a chemical compound with molecular formula C20H12BrFN2O3S and molecular weight 457.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(2-fluorophenyl)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: AS-871/41502270, 4-(4-bromobenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-one, 4-(4-bromobenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(thiazol-2-yl)-1H-pyrrol-2(5H)-one, (4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-(2-fluorophenyl)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione, (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(2-fluorophenyl)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
| Molecular Formula | C20H12BrFN2O3S |
|---|---|
| Molecular Weight | 457.97 g/mol |
| LogP | 4.671 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 457.9736 |
| Heavy Atoms | 28 |
| Complexity | 1096.9033 |
Chemical Identifiers
| CAS Number | 380554-17-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2/C(=C(/C3=CC=C(C=C3)Br)\O)/C(=O)C(=O)N2C4=NC=CS4)F |
Product Overview
AS-871/41502270 (CAS 380554-17-6), with molecular formula C20H12BrFN2O3S and molecular weight 457.97 g/mol. IUPAC: (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(2-fluorophenyl)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of AS-871/41502270
Property Insights of AS-871/41502270
The XLogP value of 4.671 indicates that AS-871/41502270 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/41502270. Following Lipinski's Rule of Five, AS-871/41502270 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 AS-871/41502270?
The CAS number of AS-871/41502270 is 380554-17-6.
What is the molecular formula of AS-871/41502270?
The molecular formula of AS-871/41502270 is C20H12BrFN2O3S.
What is the molecular weight of AS-871/41502270?
The molecular weight of AS-871/41502270 is 457.97 g/mol.
Where can I buy AS-871/41502270?
You can request a quote for AS-871/41502270 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/41502270?
Yes, KEHONG BIO provides custom synthesis services for AS-871/41502270 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.