1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate
TL;DR: 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate (CAS 59177-64-9) is a chemical compound with molecular formula C17H26BrNO4 and molecular weight 387.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-ethyl-N-methyladamantan-1-amine;(Z)-but-2-enedioic acid
Also Known As: 5,6-dihydro-1,4-dithiane, 2-Bromo-N-methyl-1-adamantaneethylamine maleate, 1-ADAMANTANEETHYLAMINE, 2-BROMO-N-METHYL-, MALEATE, 2-bromo-N-ethyl-N-methyladamantan-1-amine; (Z)-but-2-enedioic acid, 2-Bromo-N-ethyl-N-methyl-1-adamantanamine (2Z)-2-butenedioate (1: 1)
| Molecular Formula | C17H26BrNO4 |
|---|---|
| Molecular Weight | 387.10 g/mol |
| LogP | 2.9921 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.10452 |
| Heavy Atoms | 23 |
| Complexity | 462.98505 |
Chemical Identifiers
| CAS Number | 59177-64-9 |
|---|---|
| SMILES | CCN(C)C12CC3CC(C1)CC(C3)C2Br.C(=C\C(=O)O)\C(=O)O |
Product Overview
1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate (CAS 59177-64-9), with molecular formula C17H26BrNO4 and molecular weight 387.10 g/mol. IUPAC: 2-bromo-N-ethyl-N-methyladamantan-1-amine;(Z)-but-2-enedioic acid.
Chemical Property Profile of 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate
Property Insights of 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate
The XLogP value of 2.9921 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate. Following Lipinski's Rule of Five, 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate has 2 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 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate?
The CAS number of 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate is 59177-64-9.
What is the molecular formula of 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate?
The molecular formula of 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate is C17H26BrNO4.
What is the molecular weight of 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate?
The molecular weight of 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate is 387.10 g/mol.
Where can I buy 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate?
You can request a quote for 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate?
Yes, KEHONG BIO provides custom synthesis services for 1-Adamantaneethylamine, 2-bromo-N-methyl-, maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.