Methyl 4-chloro-3-(3-cyclohexylureido)benzoate
TL;DR: Methyl 4-chloro-3-(3-cyclohexylureido)benzoate (CAS 164653-37-6) is a chemical compound with molecular formula C15H19ClN2O3 and molecular weight 310.10843 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-chloro-3-(cyclohexylcarbamoylamino)benzoate
Also Known As: methyl 4-chloro-3-(3-cyclohexylureido)benzoate, VU0222097-4, methyl 4-chloro-3-(cyclohexylcarbamoylamino)benzoate, F3218-0057, methyl 4-chloro-3-[(cyclohexylamino)carbonylamino]benzoate
Technical Specifications
| Molecular Formula | C15H19ClN2O3 |
| Molecular Weight | 310.10843 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.10843 Da |
| Heavy Atoms | 21 |
| Complexity | 372.0 |
| SMILES | COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)NC2CCCCC2 |
| InChIKey | LYLJZYLBABSOOT-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate
Property Insights of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate
The XLogP value of 3.2 indicates that Methyl 4-chloro-3-(3-cyclohexylureido)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 4-chloro-3-(3-cyclohexylureido)benzoate. Following Lipinski's Rule of Five, Methyl 4-chloro-3-(3-cyclohexylureido)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
What is the CAS number of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate?
The CAS number of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate is 164653-37-6.
What is the molecular formula of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate?
The molecular formula of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate is C15H19ClN2O3.
What is the molecular weight of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate?
The molecular weight of Methyl 4-chloro-3-(3-cyclohexylureido)benzoate is 310.10843 g/mol.
Where can I buy Methyl 4-chloro-3-(3-cyclohexylureido)benzoate?
You can request a quote for Methyl 4-chloro-3-(3-cyclohexylureido)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-chloro-3-(3-cyclohexylureido)benzoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-chloro-3-(3-cyclohexylureido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.