![[(Tert-butylcarbamothioyl)sulfanyl]acetic acid structure](/static/products/2118/21184-93-0.webp)
[(Tert-butylcarbamothioyl)sulfanyl]acetic acid
TL;DR: [(Tert-butylcarbamothioyl)sulfanyl]acetic acid (CAS 21184-93-0) is a chemical compound with molecular formula C7H13NO2S2 and molecular weight 207.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(tert-butylcarbamothioylsulfanyl)acetic acid
Also Known As: [(tert-butylcarbamothioyl)sulfanyl]acetic acid|2-(tert-butylcarbamothioylsulfanyl)acetic acid
| Molecular Formula | C7H13NO2S2 |
|---|---|
| Molecular Weight | 207.04 g/mol |
| LogP | 1.4772 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.03877 |
| Heavy Atoms | 12 |
| Complexity | 186.33562 |
Chemical Identifiers
| CAS Number | 21184-93-0 |
|---|---|
| SMILES | CC(C)(C)NC(=S)SCC(=O)O |
Product Overview
[(Tert-butylcarbamothioyl)sulfanyl]acetic acid (CAS 21184-93-0), with molecular formula C7H13NO2S2 and molecular weight 207.04 g/mol. IUPAC: 2-(tert-butylcarbamothioylsulfanyl)acetic acid.
Chemical Property Profile of [(Tert-butylcarbamothioyl)sulfanyl]acetic acid
Property Insights of [(Tert-butylcarbamothioyl)sulfanyl]acetic acid
The XLogP value of 1.4772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(Tert-butylcarbamothioyl)sulfanyl]acetic acid. With a topological polar surface area (TPSA) of 49.33 Ų, [(Tert-butylcarbamothioyl)sulfanyl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(Tert-butylcarbamothioyl)sulfanyl]acetic acid has 2 hydrogen bond donor(s) and 3 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 [(Tert-butylcarbamothioyl)sulfanyl]acetic acid?
The CAS number of [(Tert-butylcarbamothioyl)sulfanyl]acetic acid is 21184-93-0.
What is the molecular formula of [(Tert-butylcarbamothioyl)sulfanyl]acetic acid?
The molecular formula of [(Tert-butylcarbamothioyl)sulfanyl]acetic acid is C7H13NO2S2.
What is the molecular weight of [(Tert-butylcarbamothioyl)sulfanyl]acetic acid?
The molecular weight of [(Tert-butylcarbamothioyl)sulfanyl]acetic acid is 207.04 g/mol.
Where can I buy [(Tert-butylcarbamothioyl)sulfanyl]acetic acid?
You can request a quote for [(Tert-butylcarbamothioyl)sulfanyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Tert-butylcarbamothioyl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(Tert-butylcarbamothioyl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.