4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate
TL;DR: 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate (CAS 481672-71-3) is a chemical compound with molecular formula C21H18BrNO2 and molecular weight 395.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate
Also Known As: 4-bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate, AJ-292/41945214, (4-bromophenyl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate, 4-bromobenzyl 1,2,3,4-tetrahydroacridine-9-carboxylate
| Molecular Formula | C21H18BrNO2 |
|---|---|
| Molecular Weight | 395.05 g/mol |
| LogP | 5.2331 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.0521 |
| Heavy Atoms | 25 |
| Complexity | 934.52893 |
Chemical Identifiers
| CAS Number | 481672-71-3 |
|---|---|
| SMILES | C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC4=CC=C(C=C4)Br |
Product Overview
4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate (CAS 481672-71-3), with molecular formula C21H18BrNO2 and molecular weight 395.05 g/mol. IUPAC: (4-bromophenyl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate.
Chemical Property Profile of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate
Property Insights of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate
The XLogP value of 5.2331 indicates that 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate?
The CAS number of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate is 481672-71-3.
What is the molecular formula of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate?
The molecular formula of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate is C21H18BrNO2.
What is the molecular weight of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate?
The molecular weight of 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate is 395.05 g/mol.
Where can I buy 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate?
You can request a quote for 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromobenzyl 1,2,3,4-tetrahydro-9-acridinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.