Benzyl 2-(2,3-dioxoindol-1-yl)acetate
TL;DR: Benzyl 2-(2,3-dioxoindol-1-yl)acetate (CAS 842957-60-2) is a chemical compound with molecular formula C17H13NO4 and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-(2,3-dioxoindol-1-yl)acetate
Also Known As: benzyl 2-(2,3-dioxoindol-1-yl)acetate, BAS 08977393, benzyl 2-(2,3-dioxoindolin-1-yl)acetate, benzyl 2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate, phenylmethyl 2-(2,3-dioxobenzo[d]azolidinyl)acetate
| Molecular Formula | C17H13NO4 |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 1.9593 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.08447 |
| Heavy Atoms | 22 |
| Complexity | 739.334 |
Chemical Identifiers
| CAS Number | 842957-60-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CN2C3=CC=CC=C3C(=O)C2=O |
Product Overview
Benzyl 2-(2,3-dioxoindol-1-yl)acetate (CAS 842957-60-2), with molecular formula C17H13NO4 and molecular weight 295.08 g/mol. IUPAC: benzyl 2-(2,3-dioxoindol-1-yl)acetate.
Chemical Property Profile of Benzyl 2-(2,3-dioxoindol-1-yl)acetate
Property Insights of Benzyl 2-(2,3-dioxoindol-1-yl)acetate
The XLogP value of 1.9593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl 2-(2,3-dioxoindol-1-yl)acetate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl 2-(2,3-dioxoindol-1-yl)acetate. Following Lipinski's Rule of Five, Benzyl 2-(2,3-dioxoindol-1-yl)acetate has 0 hydrogen bond donor(s) and 4 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 2-(2,3-dioxoindol-1-yl)acetate?
The CAS number of Benzyl 2-(2,3-dioxoindol-1-yl)acetate is 842957-60-2.
What is the molecular formula of Benzyl 2-(2,3-dioxoindol-1-yl)acetate?
The molecular formula of Benzyl 2-(2,3-dioxoindol-1-yl)acetate is C17H13NO4.
What is the molecular weight of Benzyl 2-(2,3-dioxoindol-1-yl)acetate?
The molecular weight of Benzyl 2-(2,3-dioxoindol-1-yl)acetate is 295.08 g/mol.
Where can I buy Benzyl 2-(2,3-dioxoindol-1-yl)acetate?
You can request a quote for Benzyl 2-(2,3-dioxoindol-1-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-(2,3-dioxoindol-1-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-(2,3-dioxoindol-1-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.