Carbonocyanidothioic amide, dimethyl-
TL;DR: Carbonocyanidothioic amide, dimethyl- (CAS 16703-47-2) is a chemical compound with molecular formula C4H6N2S and molecular weight 114.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyano-N,N-dimethylmethanethioamide
Also Known As: Carbonocyanidothioic amide, dimethyl-, N,N-Dimethylcyanothioformamide, 1-cyano-N,N-dimethylmethanethioamide, Dimethylthiocarbamoyl cyanide, N,N-Dimethylthiocarbamyl cyanide
| Molecular Formula | C4H6N2S |
|---|---|
| Molecular Weight | 114.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.02517 |
| Heavy Atoms | 7 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 16703-47-2 |
|---|---|
| SMILES | CN(C)C(=S)C#N |
| InChIKey | OLJDIRLJSRSJNR-UHFFFAOYSA-N |
Product Overview
Carbonocyanidothioic amide, dimethyl- (CAS 16703-47-2), with molecular formula C4H6N2S and molecular weight 114.03 g/mol. IUPAC: 1-cyano-N,N-dimethylmethanethioamide.
Chemical Property Profile of Carbonocyanidothioic amide, dimethyl-
Property Insights of Carbonocyanidothioic amide, dimethyl-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbonocyanidothioic amide, dimethyl-. With a topological polar surface area (TPSA) of 59.1 Ų, Carbonocyanidothioic amide, dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbonocyanidothioic amide, dimethyl- has 0 hydrogen bond donor(s) and 2 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 Carbonocyanidothioic amide, dimethyl-?
The CAS number of Carbonocyanidothioic amide, dimethyl- is 16703-47-2.
What is the molecular formula of Carbonocyanidothioic amide, dimethyl-?
The molecular formula of Carbonocyanidothioic amide, dimethyl- is C4H6N2S.
What is the molecular weight of Carbonocyanidothioic amide, dimethyl-?
The molecular weight of Carbonocyanidothioic amide, dimethyl- is 114.03 g/mol.
Where can I buy Carbonocyanidothioic amide, dimethyl-?
You can request a quote for Carbonocyanidothioic amide, dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonocyanidothioic amide, dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Carbonocyanidothioic amide, dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.