![2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid structure](/static/products/158/15810-20-5.png)
2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid
TL;DR: 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid (CAS 15810-20-5) is a chemical compound with molecular formula C12H14O4S2 and molecular weight 286.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid
Also Known As: (1-phenyl-ethylidenedimercapto)-di-acetic acid, 2-[1-(carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid, 2-[1-(carboxymethylsulfanyl)-1-phenyl-ethyl]sulfanylacetic Acid
| Molecular Formula | C12H14O4S2 |
|---|---|
| Molecular Weight | 286.03 g/mol |
| LogP | 2.4949 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 286.03336 |
| Heavy Atoms | 18 |
| Complexity | 401.3454 |
Chemical Identifiers
| CAS Number | 15810-20-5 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)(SCC(=O)O)SCC(=O)O |
Product Overview
2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid (CAS 15810-20-5), with molecular formula C12H14O4S2 and molecular weight 286.03 g/mol. IUPAC: 2-[1-(carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid.
Chemical Property Profile of 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid
Property Insights of 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid
The XLogP value of 2.4949 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid. Following Lipinski's Rule of Five, 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid has 2 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 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid?
The CAS number of 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid is 15810-20-5.
What is the molecular formula of 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid?
The molecular formula of 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid is C12H14O4S2.
What is the molecular weight of 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid?
The molecular weight of 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid is 286.03 g/mol.
Where can I buy 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid?
You can request a quote for 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(Carboxymethylsulfanyl)-1-phenylethyl]sulfanylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.