(2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate
TL;DR: (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate (CAS 84333-60-8) is a chemical compound with molecular formula C20H25NO5 and molecular weight 359.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate
Also Known As: N-Didemethyltrimebutine, N,N-DidesmethylTrimebutine, N,N-Didesmethyl Trimebutine Hydrochloride, N,N-DIDESMETHYL TRIMEBUTINE, J1.824.129C
| Molecular Formula | C20H25NO5 |
|---|---|
| Molecular Weight | 359.17 g/mol |
| LogP | 3.1334 |
| Topological Polar Surface Area | 80.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 359.17328 |
| Heavy Atoms | 26 |
| Complexity | 722.1168 |
Chemical Identifiers
| CAS Number | 84333-60-8 |
|---|---|
| SMILES | CCC(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)N |
Product Overview
(2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate (CAS 84333-60-8), with molecular formula C20H25NO5 and molecular weight 359.17 g/mol. IUPAC: (2-amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate.
Chemical Property Profile of (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate
Property Insights of (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate
The XLogP value of 3.1334 indicates that (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.01 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate has 1 hydrogen bond donor(s) and 6 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-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate?
The CAS number of (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate is 84333-60-8.
What is the molecular formula of (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate?
The molecular formula of (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate is C20H25NO5.
What is the molecular weight of (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate?
The molecular weight of (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate is 359.17 g/mol.
Where can I buy (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate?
You can request a quote for (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Amino-2-phenylbutyl) 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.