(7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate
TL;DR: (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate (CAS 852040-79-0) is a chemical compound with molecular formula C17H11Cl2NO4 and molecular weight 363.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-methyl-2-oxochromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate
Also Known As: (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate, (7-methyl-2-oxochromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate
| Molecular Formula | C17H11Cl2NO4 |
|---|---|
| Molecular Weight | 363.01 g/mol |
| LogP | 4.16022 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.0065 |
| Heavy Atoms | 24 |
| Complexity | 997.53735 |
Chemical Identifiers
| CAS Number | 852040-79-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C=CC(=N3)Cl)Cl |
Product Overview
(7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate (CAS 852040-79-0), with molecular formula C17H11Cl2NO4 and molecular weight 363.01 g/mol. IUPAC: (7-methyl-2-oxochromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate.
Chemical Property Profile of (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate
Property Insights of (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate
The XLogP value of 4.16022 indicates that (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate. Following Lipinski's Rule of Five, (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate has 0 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 (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate?
The CAS number of (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate is 852040-79-0.
What is the molecular formula of (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate?
The molecular formula of (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate is C17H11Cl2NO4.
What is the molecular weight of (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate?
The molecular weight of (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate is 363.01 g/mol.
Where can I buy (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate?
You can request a quote for (7-methyl-2-oxo-2H-chromen-4-yl)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 (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (7-methyl-2-oxo-2H-chromen-4-yl)methyl 3,6-dichloropyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.