2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate
TL;DR: 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate (CAS 389583-95-3) is a chemical compound with molecular formula C18H17NO4 and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,3-dihydroindol-1-yl)-2-oxoethyl] 4-methoxybenzoate
Also Known As: 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate, [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] 4-methoxybenzoate
| Molecular Formula | C18H17NO4 |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 2.4413 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.11575 |
| Heavy Atoms | 23 |
| Complexity | 724.0564 |
Chemical Identifiers
| CAS Number | 389583-95-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OCC(=O)N2CCC3=CC=CC=C32 |
Product Overview
2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate (CAS 389583-95-3), with molecular formula C18H17NO4 and molecular weight 311.12 g/mol. IUPAC: [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] 4-methoxybenzoate.
Chemical Property Profile of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate
Property Insights of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate
The XLogP value of 2.4413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate. With a topological polar surface area (TPSA) of 55.84 Ų, 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate 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-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate?
The CAS number of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate is 389583-95-3.
What is the molecular formula of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate?
The molecular formula of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate is C18H17NO4.
What is the molecular weight of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate?
The molecular weight of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate is 311.12 g/mol.
Where can I buy 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate?
You can request a quote for 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.