2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline
TL;DR: 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline (CAS 596084-02-5) is a chemical compound with molecular formula C17H16F3NO2 and molecular weight 323.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-5-(trifluoromethyl)-2,3-dihydro-1H-indole
Also Known As: 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline, 2-(3,4-dimethoxyphenyl)-5-(trifluoromethyl)-2,3-dihydro-1H-indole
| Molecular Formula | C17H16F3NO2 |
|---|---|
| Molecular Weight | 323.11 g/mol |
| LogP | 4.4319 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.1133 |
| Heavy Atoms | 23 |
| Complexity | 728.2638 |
Chemical Identifiers
| CAS Number | 596084-02-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC3=C(N2)C=CC(=C3)C(F)(F)F)OC |
Product Overview
2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline (CAS 596084-02-5), with molecular formula C17H16F3NO2 and molecular weight 323.11 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-5-(trifluoromethyl)-2,3-dihydro-1H-indole.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline
Property Insights of 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline
The XLogP value of 4.4319 indicates that 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline has 1 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-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline?
The CAS number of 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline is 596084-02-5.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline?
The molecular formula of 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline is C17H16F3NO2.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline?
The molecular weight of 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline is 323.11 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline?
You can request a quote for 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)-5-(trifluoromethyl)indoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.