![Ethyl 2-amino-5-[2-naphthylthio]benzoate structure](/static/products/5297/52979-20-1.webp)
Ethyl 2-amino-5-[2-naphthylthio]benzoate
TL;DR: Ethyl 2-amino-5-[2-naphthylthio]benzoate (CAS 52979-20-1) is a chemical compound with molecular formula C19H17NO2S and molecular weight 323.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-5-naphthalen-2-ylsulfanylbenzoate
Also Known As: Ethyl 2-amino-5-[2-naphthylthio]benzoate, ethyl 2-amino-5-naphthalen-2-ylsulfanylbenzoate, Ethyl 2-amino-5-(2-naphthylthio)benzoate, Ethyl 2-amino-5-(2-naphthylsulfanyl)benzoate #, Ethyl 2-amino-5-[(naphthalen-2-yl)sulfanyl]benzoate
| Molecular Formula | C19H17NO2S |
|---|---|
| Molecular Weight | 323.10 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.098 |
| Heavy Atoms | 23 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 52979-20-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=CC(=C1)SC2=CC3=CC=CC=C3C=C2)N |
| InChIKey | TZKBHVKCNLILJA-UHFFFAOYSA-N |
Product Overview
Ethyl 2-amino-5-[2-naphthylthio]benzoate (CAS 52979-20-1), with molecular formula C19H17NO2S and molecular weight 323.10 g/mol. IUPAC: ethyl 2-amino-5-naphthalen-2-ylsulfanylbenzoate.
Chemical Property Profile of Ethyl 2-amino-5-[2-naphthylthio]benzoate
Property Insights of Ethyl 2-amino-5-[2-naphthylthio]benzoate
The XLogP value of 5.3 indicates that Ethyl 2-amino-5-[2-naphthylthio]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-amino-5-[2-naphthylthio]benzoate. Following Lipinski's Rule of Five, Ethyl 2-amino-5-[2-naphthylthio]benzoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-amino-5-[2-naphthylthio]benzoate?
The CAS number of Ethyl 2-amino-5-[2-naphthylthio]benzoate is 52979-20-1.
What is the molecular formula of Ethyl 2-amino-5-[2-naphthylthio]benzoate?
The molecular formula of Ethyl 2-amino-5-[2-naphthylthio]benzoate is C19H17NO2S.
What is the molecular weight of Ethyl 2-amino-5-[2-naphthylthio]benzoate?
The molecular weight of Ethyl 2-amino-5-[2-naphthylthio]benzoate is 323.10 g/mol.
Where can I buy Ethyl 2-amino-5-[2-naphthylthio]benzoate?
You can request a quote for Ethyl 2-amino-5-[2-naphthylthio]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-amino-5-[2-naphthylthio]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-amino-5-[2-naphthylthio]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.