![[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate structure](/static/products/4797/479707-99-8.webp)
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate
TL;DR: [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate (CAS 479707-99-8) is a chemical compound with molecular formula C17H21NO3 and molecular weight 287.15 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] benzoate
Also Known As: [2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate|2-{[2-(Cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl benzoate|MLS001003619|SMR000377578
| Molecular Formula | C17H21NO3 |
|---|---|
| Molecular Weight | 287.15 g/mol |
| LogP | 2.8501 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.15213 |
| Heavy Atoms | 21 |
| Complexity | 508.02634 |
Chemical Identifiers
| CAS Number | 479707-99-8 |
|---|---|
| SMILES | C1CCC(=CC1)CCNC(=O)COC(=O)C2=CC=CC=C2 |
Product Overview
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate (CAS 479707-99-8), with molecular formula C17H21NO3 and molecular weight 287.15 g/mol. IUPAC: [2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate.
Chemical Property Profile of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate
Property Insights of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate
The XLogP value of 2.8501 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate. With a topological polar surface area (TPSA) of 55.4 Ų, [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate 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] benzoate?
The CAS number of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate is 479707-99-8.
What is the molecular formula of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate?
The molecular formula of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate is C17H21NO3.
What is the molecular weight of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate?
The molecular weight of [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate is 287.15 g/mol.
Where can I buy [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate?
You can request a quote for [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate 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] benzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.