2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate
TL;DR: 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate (CAS 76139-04-3) is a chemical compound with molecular formula C14H15NO4 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1-acetyl-2,3-dihydroindol-5-yl)-2-oxoethyl] acetate
Also Known As: ChemDiv3_010102, IDI1_028012, 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate, BRD-K00341142-001-01-0, [2-(1-acetyl-2,3-dihydroindol-5-yl)-2-oxoethyl] acetate
| Molecular Formula | C14H15NO4 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 1.3414 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.1001 |
| Heavy Atoms | 19 |
| Complexity | 550.377 |
Chemical Identifiers
| CAS Number | 76139-04-3 |
|---|---|
| SMILES | CC(=O)N1CCC2=C1C=CC(=C2)C(=O)COC(=O)C |
Product Overview
2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate (CAS 76139-04-3), with molecular formula C14H15NO4 and molecular weight 261.10 g/mol. IUPAC: [2-(1-acetyl-2,3-dihydroindol-5-yl)-2-oxoethyl] acetate.
Chemical Property Profile of 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate
Property Insights of 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate
The XLogP value of 1.3414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate. Following Lipinski's Rule of Five, 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl 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 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate?
The CAS number of 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate is 76139-04-3.
What is the molecular formula of 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate?
The molecular formula of 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate is C14H15NO4.
What is the molecular weight of 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate?
The molecular weight of 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate is 261.10 g/mol.
Where can I buy 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate?
You can request a quote for 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-acetyl-2,3-dihydro-1H-indol-5-yl)-2-oxoethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.