![Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate structure](/static/products/6258/625822-63-1.webp)
Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate
TL;DR: Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate (CAS 625822-63-1) is a chemical compound with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-pyridin-2-ylsulfanylacetyl)amino]benzoate
Also Known As: ChemDiv2_004642, IDI1_003357, methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate, methyl 2-[(2-pyridin-2-ylsulfanylacetyl)amino]benzoate, Methyl 2-(2-(pyridin-2-ylthio)acetamido)benzoate
| Molecular Formula | C15H14N2O3S |
|---|---|
| Molecular Weight | 302.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 93.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.0725 |
| Heavy Atoms | 21 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 625822-63-1 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=CC=N2 |
| InChIKey | RQXRZTHBHUMLKF-UHFFFAOYSA-N |
Product Overview
Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate (CAS 625822-63-1), with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol. IUPAC: methyl 2-[(2-pyridin-2-ylsulfanylacetyl)amino]benzoate.
Chemical Property Profile of Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate
Property Insights of Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate
The XLogP value of 3.2 indicates that Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate. Following Lipinski's Rule of Five, Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate 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 Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate?
The CAS number of Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate is 625822-63-1.
What is the molecular formula of Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate?
The molecular formula of Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate is C15H14N2O3S.
What is the molecular weight of Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate?
The molecular weight of Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate is 302.07 g/mol.
Where can I buy Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate?
You can request a quote for Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[2-(pyridin-2-ylsulfanyl)acetamido]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.