(2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate
TL;DR: (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate (CAS 816-75-1) is a chemical compound with molecular formula C5H10N2OS2 and molecular weight 178.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate
Also Known As: (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate, NCI60_003899, 2-Amino-2-oxoethyl dimethylcarbamodithioate, 2-[(DIMETHYLCARBAMOTHIOYL)SULFANYL]ACETAMIDE, Carbamodithioic acid, N,N-dimethyl-, 2-amino-2-oxoethyl ester
| Molecular Formula | C5H10N2OS2 |
|---|---|
| Molecular Weight | 178.02 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.02345 |
| Heavy Atoms | 10 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 816-75-1 |
|---|---|
| SMILES | CN(C)C(=S)SCC(=O)N |
| InChIKey | YVDBHZMPCSXUHG-UHFFFAOYSA-N |
Product Overview
(2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate (CAS 816-75-1), with molecular formula C5H10N2OS2 and molecular weight 178.02 g/mol. IUPAC: (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate.
Chemical Property Profile of (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate
Property Insights of (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate. Following Lipinski's Rule of Five, (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate has 1 hydrogen bond donor(s) and 3 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-amino-2-oxoethyl) N,N-dimethylcarbamodithioate?
The CAS number of (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate is 816-75-1.
What is the molecular formula of (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate?
The molecular formula of (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate is C5H10N2OS2.
What is the molecular weight of (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate?
The molecular weight of (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate is 178.02 g/mol.
Where can I buy (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate?
You can request a quote for (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.