(Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate
TL;DR: (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate (CAS 568576-30-7) is a chemical compound with molecular formula C20H27ClN2O3 and molecular weight 378.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(dicyclohexylamino)-2-oxoethyl] 6-chloropyridine-3-carboxylate
Also Known As: (dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate, [2-(dicyclohexylamino)-2-oxoethyl] 6-chloropyridine-3-carboxylate
| Molecular Formula | C20H27ClN2O3 |
|---|---|
| Molecular Weight | 378.17 g/mol |
| LogP | 4.3858 |
| Topological Polar Surface Area | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.17102 |
| Heavy Atoms | 26 |
| Complexity | 589.98724 |
Chemical Identifiers
| CAS Number | 568576-30-7 |
|---|---|
| SMILES | C1CCC(CC1)N(C2CCCCC2)C(=O)COC(=O)C3=CN=C(C=C3)Cl |
Product Overview
(Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate (CAS 568576-30-7), with molecular formula C20H27ClN2O3 and molecular weight 378.17 g/mol. IUPAC: [2-(dicyclohexylamino)-2-oxoethyl] 6-chloropyridine-3-carboxylate.
Chemical Property Profile of (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate
Property Insights of (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate
The XLogP value of 4.3858 indicates that (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.5 Ų, (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate has 0 hydrogen bond donor(s) and 4 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 (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
The CAS number of (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate is 568576-30-7.
What is the molecular formula of (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
The molecular formula of (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate is C20H27ClN2O3.
What is the molecular weight of (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
The molecular weight of (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate is 378.17 g/mol.
Where can I buy (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
You can request a quote for (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Dicyclohexylcarbamoyl)methyl 6-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.