2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate
TL;DR: 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate (CAS 730940-38-2) is a chemical compound with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(methylamino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
Also Known As: starbld0008080, 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate, (methylcarbamoyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate, [2-(methylamino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
| Molecular Formula | C10H12N2O3S |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | 0.7063 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.05687 |
| Heavy Atoms | 16 |
| Complexity | 395.40546 |
Chemical Identifiers
| CAS Number | 730940-38-2 |
|---|---|
| SMILES | CNC(=O)COC(=O)C1=C(N=CC=C1)SC |
Product Overview
2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate (CAS 730940-38-2), with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol. IUPAC: [2-(methylamino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate.
Chemical Property Profile of 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate
Property Insights of 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate
The XLogP value of 0.7063 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate. Following Lipinski's Rule of Five, 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate 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 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate?
The CAS number of 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate is 730940-38-2.
What is the molecular formula of 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate?
The molecular formula of 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate is C10H12N2O3S.
What is the molecular weight of 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate?
The molecular weight of 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate is 240.06 g/mol.
Where can I buy 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate?
You can request a quote for 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylamino)-2-oxoethyl 2-(methylthio)nicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.