1,3-Dithiolan-2-ylidenecyanamide
TL;DR: 1,3-Dithiolan-2-ylidenecyanamide (CAS 10191-72-7) is a chemical compound with molecular formula C4H4N2S2 and molecular weight 143.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dithiolan-2-ylidenecyanamide
Also Known As: 1,3-dithiolan-2-ylidenecyanamide, 2-(cyanoimino)-1,3-dithiolane, N-(1,3-dithiolan-2-yliden)cyanamide, [(1,3-dithiolan-2-ylidene)amino]formonitrile, Cyanamide, 1,3-dithiolan-2-ylidene-
| Molecular Formula | C4H4N2S2 |
|---|---|
| Molecular Weight | 143.98 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 86.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 143.9816 |
| Heavy Atoms | 8 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 10191-72-7 |
|---|---|
| SMILES | C1CSC(=NC#N)S1 |
| InChIKey | VKWDKDAWFFPNDD-UHFFFAOYSA-N |
Product Overview
1,3-Dithiolan-2-ylidenecyanamide (CAS 10191-72-7), with molecular formula C4H4N2S2 and molecular weight 143.98 g/mol. IUPAC: 1,3-dithiolan-2-ylidenecyanamide.
Chemical Property Profile of 1,3-Dithiolan-2-ylidenecyanamide
Property Insights of 1,3-Dithiolan-2-ylidenecyanamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dithiolan-2-ylidenecyanamide. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dithiolan-2-ylidenecyanamide. Following Lipinski's Rule of Five, 1,3-Dithiolan-2-ylidenecyanamide has 0 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 1,3-Dithiolan-2-ylidenecyanamide?
The CAS number of 1,3-Dithiolan-2-ylidenecyanamide is 10191-72-7.
What is the molecular formula of 1,3-Dithiolan-2-ylidenecyanamide?
The molecular formula of 1,3-Dithiolan-2-ylidenecyanamide is C4H4N2S2.
What is the molecular weight of 1,3-Dithiolan-2-ylidenecyanamide?
The molecular weight of 1,3-Dithiolan-2-ylidenecyanamide is 143.98 g/mol.
Where can I buy 1,3-Dithiolan-2-ylidenecyanamide?
You can request a quote for 1,3-Dithiolan-2-ylidenecyanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithiolan-2-ylidenecyanamide?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithiolan-2-ylidenecyanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.