[2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate
TL;DR: [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate (CAS 733022-05-4) is a chemical compound with molecular formula C17H26BrNO3 and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate
Also Known As: [2-(diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate|[2-(diethylamino)-2-oxoethyl] (5S,7R)-3-bromoadamantane-1-carboxylate
| Molecular Formula | C17H26BrNO3 |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 3.1319 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.10962 |
| Heavy Atoms | 22 |
| Complexity | 460.5245 |
Chemical Identifiers
| CAS Number | 733022-05-4 |
|---|---|
| SMILES | CCN(CC)C(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)Br |
Product Overview
[2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate (CAS 733022-05-4), with molecular formula C17H26BrNO3 and molecular weight 371.11 g/mol. IUPAC: [2-(diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate.
Chemical Property Profile of [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate
Property Insights of [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate
The XLogP value of 3.1319 indicates that [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate has 0 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 [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate?
The CAS number of [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate is 733022-05-4.
What is the molecular formula of [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate?
The molecular formula of [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate is C17H26BrNO3.
What is the molecular weight of [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate?
The molecular weight of [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate is 371.11 g/mol.
Where can I buy [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate?
You can request a quote for [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(Diethylamino)-2-oxoethyl] 3-bromoadamantane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.