![methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate structure](/static/products/5107/510722-08-4.webp)
methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate
TL;DR: methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate (CAS 510722-08-4) is a chemical compound with molecular formula C13H10F3NO3 and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-(2,2,2-trifluoroacetyl)indol-1-yl]acetate
Also Known As: BAS 04819407, methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate, methyl 2-[3-(2,2,2-trifluoroacetyl)indolyl]acetate, methyl 2-[3-(2,2,2-trifluoroacetyl)indol-1-yl]acetate, methyl 2-(3-(2,2,2-trifluoroacetyl)-1H-indol-1-yl)acetate
| Molecular Formula | C13H10F3NO3 |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 2.5593 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.06128 |
| Heavy Atoms | 20 |
| Complexity | 673.0415 |
Chemical Identifiers
| CAS Number | 510722-08-4 |
|---|---|
| SMILES | COC(=O)CN1C=C(C2=CC=CC=C21)C(=O)C(F)(F)F |
Product Overview
methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate (CAS 510722-08-4), with molecular formula C13H10F3NO3 and molecular weight 285.06 g/mol. IUPAC: methyl 2-[3-(2,2,2-trifluoroacetyl)indol-1-yl]acetate.
Chemical Property Profile of methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate
Property Insights of methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate
The XLogP value of 2.5593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate. With a topological polar surface area (TPSA) of 48.3 Ų, methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate 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 methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate?
The CAS number of methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate is 510722-08-4.
What is the molecular formula of methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate?
The molecular formula of methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate is C13H10F3NO3.
What is the molecular weight of methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate?
The molecular weight of methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate is 285.06 g/mol.
Where can I buy methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate?
You can request a quote for methyl [3-(trifluoroacetyl)-1H-indol-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 methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl [3-(trifluoroacetyl)-1H-indol-1-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.