Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate
TL;DR: Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate (CAS 524019-76-9) is a chemical compound with molecular formula C25H16N2O4S and molecular weight 440.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 1,3-dioxo-2-(4-phenyl-1,3-thiazol-2-yl)isoindole-5-carboxylate
Also Known As: benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate, Benzyl 1,3-dioxo-2-(4-phenyl-1,3-thiazol-2-yl)isoindole-5-carboxylate, benzyl 1,3-dioxo-2-(4-phenyl-1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxylate
| Molecular Formula | C25H16N2O4S |
|---|---|
| Molecular Weight | 440.08 g/mol |
| LogP | 4.9677 |
| Topological Polar Surface Area | 76.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.08307 |
| Heavy Atoms | 32 |
| Complexity | 1332.5812 |
Chemical Identifiers
| CAS Number | 524019-76-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=NC(=CS4)C5=CC=CC=C5 |
Product Overview
Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate (CAS 524019-76-9), with molecular formula C25H16N2O4S and molecular weight 440.08 g/mol. IUPAC: benzyl 1,3-dioxo-2-(4-phenyl-1,3-thiazol-2-yl)isoindole-5-carboxylate.
Chemical Property Profile of Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate
Property Insights of Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate
The XLogP value of 4.9677 indicates that Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate. Following Lipinski's Rule of Five, Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate has 0 hydrogen bond donor(s) and 6 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 Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate?
The CAS number of Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate is 524019-76-9.
What is the molecular formula of Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate?
The molecular formula of Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate is C25H16N2O4S.
What is the molecular weight of Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate?
The molecular weight of Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate is 440.08 g/mol.
Where can I buy Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate?
You can request a quote for Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 1,3-dioxo-2-(4-phenylthiazol-2-yl)isoindoline-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.