2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate
TL;DR: 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate (CAS 391598-48-4) is a chemical compound with molecular formula C17H13F2NO3 and molecular weight 317.09 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] 2,4-difluorobenzoate
Also Known As: 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate, [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] 2,4-difluorobenzoate
| Molecular Formula | C17H13F2NO3 |
|---|---|
| Molecular Weight | 317.09 g/mol |
| LogP | 2.7109 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.08636 |
| Heavy Atoms | 23 |
| Complexity | 776.18384 |
Chemical Identifiers
| CAS Number | 391598-48-4 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C(=O)COC(=O)C3=C(C=C(C=C3)F)F |
Product Overview
2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate (CAS 391598-48-4), with molecular formula C17H13F2NO3 and molecular weight 317.09 g/mol. IUPAC: [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] 2,4-difluorobenzoate.
Chemical Property Profile of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate
Property Insights of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate
The XLogP value of 2.7109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate. With a topological polar surface area (TPSA) of 46.61 Ų, 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate 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 2,4-difluorobenzoate has 0 hydrogen bond donor(s) and 3 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 2,4-difluorobenzoate?
The CAS number of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate is 391598-48-4.
What is the molecular formula of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate?
The molecular formula of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate is C17H13F2NO3.
What is the molecular weight of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate?
The molecular weight of 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate is 317.09 g/mol.
Where can I buy 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate?
You can request a quote for 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate 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 2,4-difluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl 2,4-difluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.