(Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate
TL;DR: (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate (CAS 877241-46-8) is a chemical compound with molecular formula C14H16Cl2N2O3 and molecular weight 330.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(cyclohexylamino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate
Also Known As: (cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate, [2-(cyclohexylamino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate
| Molecular Formula | C14H16Cl2N2O3 |
|---|---|
| Molecular Weight | 330.05 g/mol |
| LogP | 2.9941 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.0538 |
| Heavy Atoms | 21 |
| Complexity | 530.95044 |
Chemical Identifiers
| CAS Number | 877241-46-8 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)COC(=O)C2=C(C=CC(=N2)Cl)Cl |
Product Overview
(Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate (CAS 877241-46-8), with molecular formula C14H16Cl2N2O3 and molecular weight 330.05 g/mol. IUPAC: [2-(cyclohexylamino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate.
Chemical Property Profile of (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate
Property Insights of (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate
The XLogP value of 2.9941 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate. Following Lipinski's Rule of Five, (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate has 1 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 (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate?
The CAS number of (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate is 877241-46-8.
What is the molecular formula of (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate?
The molecular formula of (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate is C14H16Cl2N2O3.
What is the molecular weight of (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate?
The molecular weight of (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate is 330.05 g/mol.
Where can I buy (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate?
You can request a quote for (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Cyclohexylcarbamoyl)methyl 3,6-dichloropyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.