![[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate structure](/static/products/4754/475416-00-3.webp)
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate
TL;DR: [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate (CAS 475416-00-3) is a chemical compound with molecular formula C17H20BrNO3 and molecular weight 365.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate
Also Known As: [2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate|2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl 2-bromobenzoate|MLS001033118|SMR000385484
| Molecular Formula | C17H20BrNO3 |
|---|---|
| Molecular Weight | 365.06 g/mol |
| LogP | 3.6126 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.06265 |
| Heavy Atoms | 22 |
| Complexity | 568.7774 |
Chemical Identifiers
| CAS Number | 475416-00-3 |
|---|---|
| SMILES | C1CCC(=CC1)CCNC(=O)COC(=O)C2=CC=CC=C2Br |
Product Overview
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate (CAS 475416-00-3), with molecular formula C17H20BrNO3 and molecular weight 365.06 g/mol. IUPAC: [2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate.
Chemical Property Profile of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate
Property Insights of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate
The XLogP value of 3.6126 indicates that [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate has 1 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-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate?
The CAS number of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate is 475416-00-3.
What is the molecular formula of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate?
The molecular formula of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate is C17H20BrNO3.
What is the molecular weight of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate?
The molecular weight of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate is 365.06 g/mol.
Where can I buy [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate?
You can request a quote for [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.