N-(2-Aminoethyl)carbamodithioic acid
TL;DR: N-(2-Aminoethyl)carbamodithioic acid (CAS 20950-84-9) is a chemical compound with molecular formula C3H8N2S2 and molecular weight 136.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethylcarbamodithioic acid
Also Known As: 2-aminoethylcarbamodithioic acid, Preparation 275, (2-Aminoethyl)dithiocarbamic acid, (2-Aminoethyl)carbamodithioic acid, NCIStruc1_001878
| Molecular Formula | C3H8N2S2 |
|---|---|
| Molecular Weight | 136.01 g/mol |
| LogP | -0.2506 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.0129 |
| Heavy Atoms | 7 |
| Complexity | 63.955246 |
Chemical Identifiers
| CAS Number | 20950-84-9 |
|---|---|
| SMILES | C(CNC(=S)S)N |
Product Overview
N-(2-Aminoethyl)carbamodithioic acid (CAS 20950-84-9), with molecular formula C3H8N2S2 and molecular weight 136.01 g/mol. IUPAC: 2-aminoethylcarbamodithioic acid.
Chemical Property Profile of N-(2-Aminoethyl)carbamodithioic acid
Property Insights of N-(2-Aminoethyl)carbamodithioic acid
The XLogP value of -0.2506 indicates that N-(2-Aminoethyl)carbamodithioic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.05 Ų, N-(2-Aminoethyl)carbamodithioic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Aminoethyl)carbamodithioic acid has 3 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 N-(2-Aminoethyl)carbamodithioic acid?
The CAS number of N-(2-Aminoethyl)carbamodithioic acid is 20950-84-9.
What is the molecular formula of N-(2-Aminoethyl)carbamodithioic acid?
The molecular formula of N-(2-Aminoethyl)carbamodithioic acid is C3H8N2S2.
What is the molecular weight of N-(2-Aminoethyl)carbamodithioic acid?
The molecular weight of N-(2-Aminoethyl)carbamodithioic acid is 136.01 g/mol.
Where can I buy N-(2-Aminoethyl)carbamodithioic acid?
You can request a quote for N-(2-Aminoethyl)carbamodithioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Aminoethyl)carbamodithioic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Aminoethyl)carbamodithioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.