![[(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate structure](/static/products/100/1002208-97-0.png)
[(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate
TL;DR: [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate (CAS 1002208-97-0) is a chemical compound with molecular formula C24H32N2O4 and molecular weight 412.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 4-oxo-4-(4-pentylphenyl)butanoate
Also Known As: [(1-cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate|[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 4-oxo-4-(4-pentylphenyl)butanoate|EN300-26685707
| Molecular Formula | C24H32N2O4 |
|---|---|
| Molecular Weight | 412.24 g/mol |
| LogP | 4.26808 |
| Topological Polar Surface Area | 96.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 412.2362 |
| Heavy Atoms | 30 |
| Complexity | 758.40576 |
Chemical Identifiers
| CAS Number | 1002208-97-0 |
|---|---|
| SMILES | CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)NC2(CCCCC2)C#N |
Product Overview
[(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate (CAS 1002208-97-0), with molecular formula C24H32N2O4 and molecular weight 412.24 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 4-oxo-4-(4-pentylphenyl)butanoate.
Chemical Property Profile of [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate
Property Insights of [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate
The XLogP value of 4.26808 indicates that [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.26 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate. Following Lipinski's Rule of Five, [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate has 1 hydrogen bond donor(s) and 5 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 [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate?
The CAS number of [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate is 1002208-97-0.
What is the molecular formula of [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate?
The molecular formula of [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate is C24H32N2O4.
What is the molecular weight of [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate?
The molecular weight of [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate is 412.24 g/mol.
Where can I buy [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate?
You can request a quote for [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for [(1-Cyanocyclohexyl)carbamoyl]methyl 4-oxo-4-(4-pentylphenyl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.