2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide
TL;DR: 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide (CAS 956910-01-3) is a chemical compound with molecular formula C21H25BrCl2N2O2 and molecular weight 486.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromo-1-adamantyl)-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-methylacetamide
Also Known As: 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide, 2-(3-bromo-1-adamantyl)-N-[(2,6-dichlorophenyl)carbamoylmethyl]-N-methyl-acetamide, 2-(3-bromo-1-adamantyl)-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-methylacetamide
| Molecular Formula | C21H25BrCl2N2O2 |
|---|---|
| Molecular Weight | 486.05 g/mol |
| LogP | 5.5143 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.04764 |
| Heavy Atoms | 28 |
| Complexity | 781.34534 |
Chemical Identifiers
| CAS Number | 956910-01-3 |
|---|---|
| SMILES | CN(CC(=O)NC1=C(C=CC=C1Cl)Cl)C(=O)CC23CC4CC(C2)CC(C4)(C3)Br |
Product Overview
2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide (CAS 956910-01-3), with molecular formula C21H25BrCl2N2O2 and molecular weight 486.05 g/mol. IUPAC: 2-(3-bromo-1-adamantyl)-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-methylacetamide.
Chemical Property Profile of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide
Property Insights of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide
The XLogP value of 5.5143 indicates that 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide?
The CAS number of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide is 956910-01-3.
What is the molecular formula of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide?
The molecular formula of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide is C21H25BrCl2N2O2.
What is the molecular weight of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide?
The molecular weight of 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide is 486.05 g/mol.
Where can I buy 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide?
You can request a quote for 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Bromoadamantan-1-yl)-N-(2-((2,6-dichlorophenyl)amino)-2-oxoethyl)-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.