Spirobrassinin
TL;DR: Spirobrassinin (CAS 130081-93-5) is a chemical compound with molecular formula C11H10N2OS2 and molecular weight 250.02345 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-2'-methylsulfanylspiro[1H-indole-3,5'-4H-1,3-thiazole]-2-one
Also Known As: spirobrassinin, Spirobrassinine, (-)-Spirobrassinin, (S)-(-)-Spirobrassinin, (S)-Spirobrassinin
Technical Specifications
| Molecular Formula | C11H10N2OS2 |
| Molecular Weight | 250.02345 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 92.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.02345 Da |
| Heavy Atoms | 16 |
| Complexity | 358.0 |
| SMILES | CSC1=NC[C@@]2(S1)C3=CC=CC=C3NC2=O |
| InChIKey | FUHQSEOSBHASCH-LLVKDONJSA-N |
Chemical Property Profile of Spirobrassinin
Property Insights of Spirobrassinin
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spirobrassinin. The TPSA of 92.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Spirobrassinin. Following Lipinski's Rule of Five, Spirobrassinin has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Spirobrassinin?
The CAS number of Spirobrassinin is 130081-93-5.
What is the molecular formula of Spirobrassinin?
The molecular formula of Spirobrassinin is C11H10N2OS2.
What is the molecular weight of Spirobrassinin?
The molecular weight of Spirobrassinin is 250.02345 g/mol.
Where can I buy Spirobrassinin?
You can request a quote for Spirobrassinin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Spirobrassinin?
Yes, CoreyChem provides custom synthesis services for Spirobrassinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.