Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate
TL;DR: Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate (CAS 1025621-30-0) is a chemical compound with molecular formula C21H23F3N2O4 and molecular weight 424.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate
Also Known As: Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate, ethyl 2-(4-(-O-methyloxime)-6-methyl-1-(4-(trifluoromethoxy)phenyl)-5,6,7-trihydroindol-2-yl)acetate, C21H23F3N2O4
| Molecular Formula | C21H23F3N2O4 |
|---|---|
| Molecular Weight | 424.16 g/mol |
| LogP | 4.4143 |
| Topological Polar Surface Area | 62.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.16098 |
| Heavy Atoms | 30 |
| Complexity | 932.9635 |
Chemical Identifiers
| CAS Number | 1025621-30-0 |
|---|---|
| SMILES | CCOC(=O)CC1=CC2=C(N1C3=CC=C(C=C3)OC(F)(F)F)CC(CC2=NOC)C |
Product Overview
Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate (CAS 1025621-30-0), with molecular formula C21H23F3N2O4 and molecular weight 424.16 g/mol. IUPAC: ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate.
Chemical Property Profile of Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate
Property Insights of Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate
The XLogP value of 4.4143 indicates that Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.05 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate. Following Lipinski's Rule of Five, Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate has 0 hydrogen bond donor(s) and 5 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 Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate?
The CAS number of Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate is 1025621-30-0.
What is the molecular formula of Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate?
The molecular formula of Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate is C21H23F3N2O4.
What is the molecular weight of Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate?
The molecular weight of Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate is 424.16 g/mol.
Where can I buy Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate?
You can request a quote for Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[4-methoxyimino-6-methyl-1-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-indol-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.