![[(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate structure](/static/products/874/874636-01-8.png)
[(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate
TL;DR: [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate (CAS 874636-01-8) is a chemical compound with molecular formula C17H20N2O4 and molecular weight 316.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-hydroxybenzoate
Also Known As: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate|[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-hydroxybenzoate|EN300-26680167
| Molecular Formula | C17H20N2O4 |
|---|---|
| Molecular Weight | 316.14 g/mol |
| LogP | 2.23388 |
| Topological Polar Surface Area | 90.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.1423 |
| Heavy Atoms | 23 |
| Complexity | 629.7257 |
Chemical Identifiers
| CAS Number | 874636-01-8 |
|---|---|
| SMILES | CN(C(=O)COC(=O)C1=CC=CC=C1O)C2(CCCCC2)C#N |
Product Overview
[(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate (CAS 874636-01-8), with molecular formula C17H20N2O4 and molecular weight 316.14 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-hydroxybenzoate.
Chemical Property Profile of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate
Property Insights of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate
The XLogP value of 2.23388 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate. The TPSA of 90.63 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate. Following Lipinski's Rule of Five, [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate 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)(methyl)carbamoyl]methyl 2-hydroxybenzoate?
The CAS number of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate is 874636-01-8.
What is the molecular formula of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate?
The molecular formula of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate is C17H20N2O4.
What is the molecular weight of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate?
The molecular weight of [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate is 316.14 g/mol.
Where can I buy [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate?
You can request a quote for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl 2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.