Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate
TL;DR: Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate (CAS 500359-87-5) is a chemical compound with molecular formula C23H36N2O2 and molecular weight 372.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexylmethyl 4-(N'-octylcarbamimidoyl)benzoate
Also Known As: Probes1_000268, Probes2_000032, Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate, cyclohexylmethyl 4-(N'-octylcarbamimidoyl)benzoate
| Molecular Formula | C23H36N2O2 |
|---|---|
| Molecular Weight | 372.28 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 64.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 372.27768 |
| Heavy Atoms | 27 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 500359-87-5 |
|---|---|
| SMILES | CCCCCCCCN=C(C1=CC=C(C=C1)C(=O)OCC2CCCCC2)N |
| InChIKey | ZBQNDZWYSICVFN-UHFFFAOYSA-N |
Product Overview
Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate (CAS 500359-87-5), with molecular formula C23H36N2O2 and molecular weight 372.28 g/mol. IUPAC: cyclohexylmethyl 4-(N'-octylcarbamimidoyl)benzoate.
Chemical Property Profile of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate
Property Insights of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate
The XLogP value of 6.6 indicates that Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate. Following Lipinski's Rule of Five, Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate?
The CAS number of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate is 500359-87-5.
What is the molecular formula of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate?
The molecular formula of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate is C23H36N2O2.
What is the molecular weight of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate?
The molecular weight of Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate is 372.28 g/mol.
Where can I buy Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate?
You can request a quote for Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexylmethyl 4-(N-octylcarbamimidoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.