2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid
TL;DR: 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid (CAS 68074-76-0) is a chemical compound with molecular formula C6H12N2O3S and molecular weight 192.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-diamino-4-oxobutyl)sulfanylacetic acid
Also Known As: 2-(3,4-diamino-4-oxobutyl)sulfanylacetic acid, 2-(3-amino-3-carbamoyl-propyl)sulfanylacetic acid
| Molecular Formula | C6H12N2O3S |
|---|---|
| Molecular Weight | 192.06 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 192.05687 |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 68074-76-0 |
|---|---|
| SMILES | C(CSCC(=O)O)C(C(=O)N)N |
| InChIKey | OJSSDAWGBNMAMR-UHFFFAOYSA-N |
Product Overview
2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid (CAS 68074-76-0), with molecular formula C6H12N2O3S and molecular weight 192.06 g/mol. IUPAC: 2-(3,4-diamino-4-oxobutyl)sulfanylacetic acid.
Chemical Property Profile of 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid
Property Insights of 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid
The XLogP value of -3.4 indicates that 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid. Following Lipinski's Rule of Five, 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid has 3 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 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid?
The CAS number of 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid is 68074-76-0.
What is the molecular formula of 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid?
The molecular formula of 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid is C6H12N2O3S.
What is the molecular weight of 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid?
The molecular weight of 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid is 192.06 g/mol.
Where can I buy 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid?
You can request a quote for 2-(3,4-Diamino-4-oxobutyl)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-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Diamino-4-oxobutyl)sulfanylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.