![[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate structure](/static/products/7534/753477-96-2.webp)
[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
TL;DR: [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate (CAS 753477-96-2) is a chemical compound with molecular formula C13H14Cl2N2O5S and molecular weight 380.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
Also Known As: [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate|[(1,1-dioxo-1lambda6-thiolan-3-yl)(methyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate|MLS001005322|SMR000348705|EN300-26604478
| Molecular Formula | C13H14Cl2N2O5S |
|---|---|
| Molecular Weight | 380.00 g/mol |
| LogP | 1.1907 |
| Topological Polar Surface Area | 93.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.00006 |
| Heavy Atoms | 23 |
| Complexity | 737.8805 |
Chemical Identifiers
| CAS Number | 753477-96-2 |
|---|---|
| SMILES | CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl |
Product Overview
[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate (CAS 753477-96-2), with molecular formula C13H14Cl2N2O5S and molecular weight 380.00 g/mol. IUPAC: [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate.
Chemical Property Profile of [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
Property Insights of [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
The XLogP value of 1.1907 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate. The TPSA of 93.64 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate has 0 hydrogen bond donor(s) and 6 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 [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
The CAS number of [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate is 753477-96-2.
What is the molecular formula of [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
The molecular formula of [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate is C13H14Cl2N2O5S.
What is the molecular weight of [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
The molecular weight of [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate is 380.00 g/mol.
Where can I buy [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
You can request a quote for [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 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 [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.