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Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate
TL;DR: Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate (CAS 433249-34-4) is a chemical compound with molecular formula C15H19BrN2O3 and molecular weight 354.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-2-(cyclohexylcarbamoylamino)benzoate
Also Known As: methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate, Methyl 5-bromo-2-(cyclohexylcarbamoylamino)benzoate, methyl 5-bromo-2-(3-cyclohexylureido)benzoate, methyl 5-bromo-2-[(cyclohexylamino)carbonylamino]benzoate
| Molecular Formula | C15H19BrN2O3 |
|---|---|
| Molecular Weight | 354.06 g/mol |
| LogP | 3.6899 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.05792 |
| Heavy Atoms | 21 |
| Complexity | 527.6501 |
Chemical Identifiers
| CAS Number | 433249-34-4 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)Br)NC(=O)NC2CCCCC2 |
Product Overview
Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate (CAS 433249-34-4), with molecular formula C15H19BrN2O3 and molecular weight 354.06 g/mol. IUPAC: methyl 5-bromo-2-(cyclohexylcarbamoylamino)benzoate.
Chemical Property Profile of Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate
Property Insights of Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate
The XLogP value of 3.6899 indicates that Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate. Following Lipinski's Rule of Five, Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]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 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate?
The CAS number of Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate is 433249-34-4.
What is the molecular formula of Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate?
The molecular formula of Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate is C15H19BrN2O3.
What is the molecular weight of Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate?
The molecular weight of Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate is 354.06 g/mol.
Where can I buy Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate?
You can request a quote for Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-bromo-2-[(cyclohexylcarbamoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.