![2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile structure](/static/products/5588/55883-90-4.webp)
2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile
TL;DR: 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile (CAS 55883-90-4) is a chemical compound with molecular formula C9H11N3OS and molecular weight 209.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methylsulfanyl(morpholin-4-yl)methylidene]propanedinitrile
Also Known As: 2-[(methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile, 2-((Methylthio)(morpholino)methylene)malononitrile, [(methylthio)(morpholin-4-yl)methylene]malononitrile, 2-[methylsulfanyl(morpholin-4-yl)methylidene]propanedinitrile, (METHYLTHIO)(MORPHOLIN-4-YL)METHYLENE]MALONONITRILE
| Molecular Formula | C9H11N3OS |
|---|---|
| Molecular Weight | 209.06 g/mol |
| LogP | 0.94036 |
| Topological Polar Surface Area | 60.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.06229 |
| Heavy Atoms | 14 |
| Complexity | 290.9992 |
Chemical Identifiers
| CAS Number | 55883-90-4 |
|---|---|
| SMILES | CSC(=C(C#N)C#N)N1CCOCC1 |
Product Overview
2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile (CAS 55883-90-4), with molecular formula C9H11N3OS and molecular weight 209.06 g/mol. IUPAC: 2-[methylsulfanyl(morpholin-4-yl)methylidene]propanedinitrile.
Chemical Property Profile of 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile
Property Insights of 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile
The XLogP value of 0.94036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile. The TPSA of 60.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile has 0 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-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile?
The CAS number of 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile is 55883-90-4.
What is the molecular formula of 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile?
The molecular formula of 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile is C9H11N3OS.
What is the molecular weight of 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile?
The molecular weight of 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile is 209.06 g/mol.
Where can I buy 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile?
You can request a quote for 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Methylsulfanyl)(morpholin-4-yl)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.