Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine
TL;DR: Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine (CAS 131068-49-0) is a chemical compound with molecular formula C14H20N2O9S2 and molecular weight 424.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-[(3-acetylsulfanyl-3-methylbutanoyl)-(2,5-dioxopyrrolidin-1-yl)amino]-3-sulfopropanoic acid
Also Known As: Satmbba, Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine, (3R)-3-[(3-acetylsulfanyl-3-methylbutanoyl)-(2,5-dioxopyrrolidin-1-yl)amino]-3-sulfopropanoic acid, (3R)-3-[3-(Acetylsulfanyl)-N-(2,5-dioxopyrrolidin-1-yl)-3-methylbutanamido]-3-sulfopropanoic acid, beta-Alanine, N-(3-(acetylthio)-3-methyl-1-oxobutyl)-, anhydride with 1-hydroxy-2,5-dioxo-3-pyrrolidinesulfonic acid
| Molecular Formula | C14H20N2O9S2 |
|---|---|
| Molecular Weight | 424.06 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 200.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 424.06104 |
| Heavy Atoms | 27 |
| Complexity | 754.0 |
Chemical Identifiers
| CAS Number | 131068-49-0 |
|---|---|
| SMILES | CC(=O)SC(C)(C)CC(=O)N([C@@H](CC(=O)O)S(=O)(=O)O)N1C(=O)CCC1=O |
| InChIKey | SPIFUBACRDHOKS-GFCCVEGCSA-N |
Product Overview
Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine (CAS 131068-49-0), with molecular formula C14H20N2O9S2 and molecular weight 424.06 g/mol. IUPAC: (3R)-3-[(3-acetylsulfanyl-3-methylbutanoyl)-(2,5-dioxopyrrolidin-1-yl)amino]-3-sulfopropanoic acid.
Chemical Property Profile of Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine
Property Insights of Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine
The XLogP value of -1.6 indicates that Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 200.0 Ų indicates high polarity, suggesting Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine has 2 hydrogen bond donor(s) and 10 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 Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine?
The CAS number of Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine is 131068-49-0.
What is the molecular formula of Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine?
The molecular formula of Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine is C14H20N2O9S2.
What is the molecular weight of Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine?
The molecular weight of Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine is 424.06 g/mol.
Where can I buy Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine?
You can request a quote for Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine?
Yes, KEHONG BIO provides custom synthesis services for Sulfosuccinimidyl-N-(3-(acetylthio)-3-methylbutyryl)-beta-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.