Methyl 2-(cyclohexylcarbamoylamino)benzoate
TL;DR: Methyl 2-(cyclohexylcarbamoylamino)benzoate (CAS 43121-82-0) is a chemical compound with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(cyclohexylcarbamoylamino)benzoate
Also Known As: methyl 2-(cyclohexylcarbamoylamino)benzoate, ChemDiv3_003318, 3-cyclohexylimino-2-indolinone, methyl 2-[(cyclohexylcarbamoyl)amino]benzoate, Methyl 2-(3-cyclohexylureido)benzoate
| Molecular Formula | C15H20N2O3 |
|---|---|
| Molecular Weight | 276.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.1474 |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 43121-82-0 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)NC2CCCCC2 |
| InChIKey | RIIWNZVDCNDDFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-(cyclohexylcarbamoylamino)benzoate (CAS 43121-82-0), with molecular formula C15H20N2O3 and molecular weight 276.15 g/mol. IUPAC: methyl 2-(cyclohexylcarbamoylamino)benzoate.
Chemical Property Profile of Methyl 2-(cyclohexylcarbamoylamino)benzoate
Property Insights of Methyl 2-(cyclohexylcarbamoylamino)benzoate
The XLogP value of 3.3 indicates that Methyl 2-(cyclohexylcarbamoylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(cyclohexylcarbamoylamino)benzoate. Following Lipinski's Rule of Five, Methyl 2-(cyclohexylcarbamoylamino)benzoate has 2 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 Methyl 2-(cyclohexylcarbamoylamino)benzoate?
The CAS number of Methyl 2-(cyclohexylcarbamoylamino)benzoate is 43121-82-0.
What is the molecular formula of Methyl 2-(cyclohexylcarbamoylamino)benzoate?
The molecular formula of Methyl 2-(cyclohexylcarbamoylamino)benzoate is C15H20N2O3.
What is the molecular weight of Methyl 2-(cyclohexylcarbamoylamino)benzoate?
The molecular weight of Methyl 2-(cyclohexylcarbamoylamino)benzoate is 276.15 g/mol.
Where can I buy Methyl 2-(cyclohexylcarbamoylamino)benzoate?
You can request a quote for Methyl 2-(cyclohexylcarbamoylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(cyclohexylcarbamoylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(cyclohexylcarbamoylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.