ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate
TL;DR: ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate (CAS 863006-08-0) is a chemical compound with molecular formula C18H28N2O3 and molecular weight 320.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate
Also Known As: ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate, ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate, ethyl 4-[(cyclohexylamino)carbonyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
| Molecular Formula | C18H28N2O3 |
|---|---|
| Molecular Weight | 320.21 g/mol |
| LogP | 3.36404 |
| Topological Polar Surface Area | 60.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.21 |
| Heavy Atoms | 23 |
| Complexity | 583.57745 |
Chemical Identifiers
| CAS Number | 863006-08-0 |
|---|---|
| SMILES | CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)NC2CCCCC2)C |
Product Overview
ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate (CAS 863006-08-0), with molecular formula C18H28N2O3 and molecular weight 320.21 g/mol. IUPAC: ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate.
Chemical Property Profile of ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate
Property Insights of ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate
The XLogP value of 3.36404 indicates that ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.33 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate 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 ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate?
The CAS number of ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate is 863006-08-0.
What is the molecular formula of ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate?
The molecular formula of ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate is C18H28N2O3.
What is the molecular weight of ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate?
The molecular weight of ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate is 320.21 g/mol.
Where can I buy ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate?
You can request a quote for ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(cyclohexylcarbamoyl)-1-ethyl-3,5-dimethylpyrrole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.