2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester
TL;DR: 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester (CAS 77134-89-5) is a chemical compound with molecular formula C28H35F3N2O2 and molecular weight 488.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-(2-propan-2-yl-2,3-dihydro-1H-inden-5-yl)propanoate
Also Known As: 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester, 1H-Indene-5-acetic acid, 2,3-dihydro-2-alpha-methyl-2-(1-methylethyl)-, 2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl ester, 2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-(2-propan-2-yl-2,3-dihydro-1H-inden-5-yl)propanoate, 2-{4-[3-(Trifluoromethyl)phenyl]piperazin-1-yl}ethyl 2-[2-(propan-2-yl)-2,3-dihydro-1H-inden-5-yl]propanoate, RefChem:238578
| Molecular Formula | C28H35F3N2O2 |
|---|---|
| Molecular Weight | 488.27 g/mol |
| LogP | 5.5451 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 488.26508 |
| Heavy Atoms | 35 |
| Complexity | 1029.1028 |
Chemical Identifiers
| CAS Number | 77134-89-5 |
|---|---|
| SMILES | CC(C)C1CC2=C(C1)C=C(C=C2)C(C)C(=O)OCCN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester (CAS 77134-89-5), with molecular formula C28H35F3N2O2 and molecular weight 488.27 g/mol. IUPAC: 2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-(2-propan-2-yl-2,3-dihydro-1H-inden-5-yl)propanoate.
Chemical Property Profile of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester
Property Insights of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester
The XLogP value of 5.5451 indicates that 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester?
The CAS number of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester is 77134-89-5.
What is the molecular formula of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester?
The molecular formula of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester is C28H35F3N2O2.
What is the molecular weight of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester?
The molecular weight of 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester is 488.27 g/mol.
Where can I buy 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester?
You can request a quote for 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-(isopropylindan-5-yl)acetic acid (m-trifluoromethylphenyl)piperazinoethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.