![[2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate structure](/static/products/7218/721895-53-0.webp)
[2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate
TL;DR: [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate (CAS 721895-53-0) is a chemical compound with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate
Also Known As: [2-(cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate|2-(Cycloheptylamino)-2-oxoethyl 4-(dimethylamino)benzoate|4-(dimethylamino)benzoic acid [2-(cycloheptylamino)-2-oxoethyl] ester|MLS001013373|SMR000385332
| Molecular Formula | C18H26N2O3 |
|---|---|
| Molecular Weight | 318.19 g/mol |
| LogP | 2.7484 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.19434 |
| Heavy Atoms | 23 |
| Complexity | 517.5732 |
Chemical Identifiers
| CAS Number | 721895-53-0 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=O)OCC(=O)NC2CCCCCC2 |
Product Overview
[2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate (CAS 721895-53-0), with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol. IUPAC: [2-(cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate.
Chemical Property Profile of [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate
Property Insights of [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate
The XLogP value of 2.7484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate. With a topological polar surface area (TPSA) of 58.64 Ų, [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate has 1 hydrogen bond donor(s) and 4 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-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate?
The CAS number of [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate is 721895-53-0.
What is the molecular formula of [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate?
The molecular formula of [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate is C18H26N2O3.
What is the molecular weight of [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate?
The molecular weight of [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate is 318.19 g/mol.
Where can I buy [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate?
You can request a quote for [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(Cycloheptylamino)-2-oxoethyl] 4-(dimethylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.