![[(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate structure](/static/products/100/1002410-13-0.webp)
[(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate
TL;DR: [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate (CAS 1002410-13-0) is a chemical compound with molecular formula C18H22N2O4 and molecular weight 330.15796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 4-phenoxybutanoate
Also Known As: [(1-cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate|[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 4-phenoxybutanoate|EN300-26684530|Z14788503
Technical Specifications
| Molecular Formula | C18H22N2O4 |
| Molecular Weight | 330.15796 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 88.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 330.15796 Da |
| Heavy Atoms | 24 |
| Complexity | 471.0 |
| SMILES | C1CCC(C1)(C#N)NC(=O)COC(=O)CCCOC2=CC=CC=C2 |
| InChIKey | NBESIEKKVACOIV-UHFFFAOYSA-N |
Chemical Property Profile of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate
Property Insights of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate. Following Lipinski's Rule of Five, [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate 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
What is the CAS number of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate?
The CAS number of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate is 1002410-13-0.
What is the molecular formula of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate?
The molecular formula of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate is C18H22N2O4.
What is the molecular weight of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate?
The molecular weight of [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate is 330.15796 g/mol.
Where can I buy [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate?
You can request a quote for [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate?
Yes, CoreyChem provides custom synthesis services for [(1-Cyanocyclopentyl)carbamoyl]methyl 4-phenoxybutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.