3-(Thiocarbamylthio)propionic acid
TL;DR: 3-(Thiocarbamylthio)propionic acid (CAS 4240-92-0) is a chemical compound with molecular formula C4H7NO2S2 and molecular weight 164.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-carbamothioylsulfanylpropanoic acid
Also Known As: 3-carbamothioylsulfanylpropanoic acid, 3-(carbamothioylsulfanyl)propanoic acid, NCIStruc1_000001, NCIStruc2_000291, 3-(Carbamothioylthio)propanoic acid
| Molecular Formula | C4H7NO2S2 |
|---|---|
| Molecular Weight | 164.99 g/mol |
| LogP | 0.4379 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.99182 |
| Heavy Atoms | 9 |
| Complexity | 111.736046 |
Chemical Identifiers
| CAS Number | 4240-92-0 |
|---|---|
| SMILES | C(CSC(=S)N)C(=O)O |
Product Overview
3-(Thiocarbamylthio)propionic acid (CAS 4240-92-0), with molecular formula C4H7NO2S2 and molecular weight 164.99 g/mol. IUPAC: 3-carbamothioylsulfanylpropanoic acid.
Chemical Property Profile of 3-(Thiocarbamylthio)propionic acid
Property Insights of 3-(Thiocarbamylthio)propionic acid
The XLogP value of 0.4379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Thiocarbamylthio)propionic acid. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Thiocarbamylthio)propionic acid. Following Lipinski's Rule of Five, 3-(Thiocarbamylthio)propionic 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 3-(Thiocarbamylthio)propionic acid?
The CAS number of 3-(Thiocarbamylthio)propionic acid is 4240-92-0.
What is the molecular formula of 3-(Thiocarbamylthio)propionic acid?
The molecular formula of 3-(Thiocarbamylthio)propionic acid is C4H7NO2S2.
What is the molecular weight of 3-(Thiocarbamylthio)propionic acid?
The molecular weight of 3-(Thiocarbamylthio)propionic acid is 164.99 g/mol.
Where can I buy 3-(Thiocarbamylthio)propionic acid?
You can request a quote for 3-(Thiocarbamylthio)propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Thiocarbamylthio)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Thiocarbamylthio)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.