Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate
TL;DR: Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate (CAS 330979-95-8) is a chemical compound with molecular formula C24H19NO5 and molecular weight 401.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 1,3-dioxo-2-(4-phenoxyphenyl)isoindole-5-carboxylate
Also Known As: propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate, BAS 00315748, propyl 1,3-dioxo-2-(4-phenoxyphenyl)isoindole-5-carboxylate, propyl 1,3-dioxo-2-(4-phenoxyphenyl)-2,3-dihydro-1H-isoindole-5-carboxylate, propyl 1,3-dioxo-2-(4-phenoxyphenyl)benzo[c]azoline-5-carboxylate
| Molecular Formula | C24H19NO5 |
|---|---|
| Molecular Weight | 401.13 g/mol |
| LogP | 4.8463 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.1263 |
| Heavy Atoms | 30 |
| Complexity | 1106.2001 |
Chemical Identifiers
| CAS Number | 330979-95-8 |
|---|---|
| SMILES | CCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4 |
Product Overview
Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate (CAS 330979-95-8), with molecular formula C24H19NO5 and molecular weight 401.13 g/mol. IUPAC: propyl 1,3-dioxo-2-(4-phenoxyphenyl)isoindole-5-carboxylate.
Chemical Property Profile of Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate
Property Insights of Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate
The XLogP value of 4.8463 indicates that Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate. Following Lipinski's Rule of Five, Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate has 0 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 Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate?
The CAS number of Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate is 330979-95-8.
What is the molecular formula of Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate?
The molecular formula of Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate is C24H19NO5.
What is the molecular weight of Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate?
The molecular weight of Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate is 401.13 g/mol.
Where can I buy Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate?
You can request a quote for Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 1,3-dioxo-2-(4-phenoxyphenyl)-5-isoindolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.