![[(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate structure](/static/products/3916/391653-42-2.webp)
[(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate
TL;DR: [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate (CAS 391653-42-2) is a chemical compound with molecular formula C19H20Cl2N2O4 and molecular weight 410.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
Also Known As: [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate|[2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate|EN300-26604972
| Molecular Formula | C19H20Cl2N2O4 |
|---|---|
| Molecular Weight | 410.08 g/mol |
| LogP | 4.49 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.08002 |
| Heavy Atoms | 27 |
| Complexity | 863.27356 |
Chemical Identifiers
| CAS Number | 391653-42-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl |
Product Overview
[(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate (CAS 391653-42-2), with molecular formula C19H20Cl2N2O4 and molecular weight 410.08 g/mol. IUPAC: [2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate.
Chemical Property Profile of [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate
Property Insights of [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate
The XLogP value of 4.49 indicates that [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate has 1 hydrogen bond donor(s) and 5 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 [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate?
The CAS number of [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate is 391653-42-2.
What is the molecular formula of [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate?
The molecular formula of [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate is C19H20Cl2N2O4.
What is the molecular weight of [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate?
The molecular weight of [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate is 410.08 g/mol.
Where can I buy [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate?
You can request a quote for [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(5-tert-butyl-2-methoxyphenyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.