2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide
TL;DR: 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide (CAS 24571-57-1) is a chemical compound with molecular formula C6H8N2S3 and molecular weight 203.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide
Also Known As: 2-cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide, 2-Cyano-3,3-bis(methylthio)acrylthiamide, 2-Propenethioamide, 2-cyano-3,3-bis(methylthio)-, 2-Propenethioamide,2-cyano-3,3-bis(methylthio)
| Molecular Formula | C6H8N2S3 |
|---|---|
| Molecular Weight | 203.98 g/mol |
| LogP | 1.73368 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.98495 |
| Heavy Atoms | 11 |
| Complexity | 220.47212 |
Chemical Identifiers
| CAS Number | 24571-57-1 |
|---|---|
| SMILES | CSC(=C(C#N)C(=S)N)SC |
Product Overview
2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide (CAS 24571-57-1), with molecular formula C6H8N2S3 and molecular weight 203.98 g/mol. IUPAC: 2-cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide.
Chemical Property Profile of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide
Property Insights of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide
The XLogP value of 1.73368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide. With a topological polar surface area (TPSA) of 49.81 Ų, 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide 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
Frequently Asked Questions
What is the CAS number of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide?
The CAS number of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide is 24571-57-1.
What is the molecular formula of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide?
The molecular formula of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide is C6H8N2S3.
What is the molecular weight of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide?
The molecular weight of 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide is 203.98 g/mol.
Where can I buy 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide?
You can request a quote for 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3,3-bis(methylsulfanyl)prop-2-enethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.