![[(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate structure](/static/products/848/848321-01-7.png)
[(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
TL;DR: [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate (CAS 848321-01-7) is a chemical compound with molecular formula C14H9BrCl2N2O3 and molecular weight 401.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3-bromoanilino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate
Also Known As: AB00738863-01, [(3-bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate, [2-(3-bromoanilino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate
| Molecular Formula | C14H9BrCl2N2O3 |
|---|---|
| Molecular Weight | 401.92 g/mol |
| LogP | 3.9464 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.91736 |
| Heavy Atoms | 22 |
| Complexity | 724.9842 |
Chemical Identifiers
| CAS Number | 848321-01-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)NC(=O)COC(=O)C2=C(C=CC(=N2)Cl)Cl |
Product Overview
[(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate (CAS 848321-01-7), with molecular formula C14H9BrCl2N2O3 and molecular weight 401.92 g/mol. IUPAC: [2-(3-bromoanilino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate.
Chemical Property Profile of [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
Property Insights of [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
The XLogP value of 3.9464 indicates that [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate. Following Lipinski's Rule of Five, [(3-Bromophenyl)carbamoyl]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 [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The CAS number of [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is 848321-01-7.
What is the molecular formula of [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The molecular formula of [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is C14H9BrCl2N2O3.
What is the molecular weight of [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The molecular weight of [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is 401.92 g/mol.
Where can I buy [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
You can request a quote for [(3-Bromophenyl)carbamoyl]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 [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(3-Bromophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.