![[(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate structure](/static/products/111/1117806-27-5.webp)
[(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate
TL;DR: [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate (CAS 1117806-27-5) is a chemical compound with molecular formula C19H25N3O4 and molecular weight 359.1845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(2-hydroxyethylamino)benzoate
Also Known As: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate|[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(2-hydroxyethylamino)benzoate|EN300-26680524|Z16557100
Technical Specifications
| Molecular Formula | C19H25N3O4 |
| Molecular Weight | 359.1845 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 359.1845 Da |
| Heavy Atoms | 26 |
| Complexity | 536.0 |
| SMILES | CN(C(=O)COC(=O)C1=CC=CC=C1NCCO)C2(CCCCC2)C#N |
| InChIKey | MBHPGIFNQVVPNA-UHFFFAOYSA-N |
Chemical Property Profile of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate
Property Insights of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate. Following Lipinski's Rule of Five, [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate has 2 hydrogen bond donor(s) and 6 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-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate?
The CAS number of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate is 1117806-27-5.
What is the molecular formula of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate?
The molecular formula of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate is C19H25N3O4.
What is the molecular weight of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate?
The molecular weight of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate is 359.1845 g/mol.
Where can I buy [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate?
You can request a quote for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate?
Yes, CoreyChem provides custom synthesis services for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-[(2-hydroxyethyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.