N,N-diethylethanethioamide
TL;DR: N,N-diethylethanethioamide (CAS 21010-22-0) is a chemical compound with molecular formula C6H13NS and molecular weight 131.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethylethanethioamide
Also Known As: N,N-diethylethanethioamide, N,N-Diethylthioacetamide, N,N-Diethyl-thioacetamid, ethanethioamide, N,N-diethyl-, N,N-DIETHYL THIOACETAMIDE
| Molecular Formula | C6H13NS |
|---|---|
| Molecular Weight | 131.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 131.07687 |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 21010-22-0 |
|---|---|
| SMILES | CCN(CC)C(=S)C |
| InChIKey | HAJDGVMDCJWONQ-UHFFFAOYSA-N |
Product Overview
N,N-diethylethanethioamide (CAS 21010-22-0), with molecular formula C6H13NS and molecular weight 131.08 g/mol. IUPAC: N,N-diethylethanethioamide.
Chemical Property Profile of N,N-diethylethanethioamide
Property Insights of N,N-diethylethanethioamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethylethanethioamide. With a topological polar surface area (TPSA) of 35.3 Ų, N,N-diethylethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethylethanethioamide has 0 hydrogen bond donor(s) and 1 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,N-diethylethanethioamide?
The CAS number of N,N-diethylethanethioamide is 21010-22-0.
What is the molecular formula of N,N-diethylethanethioamide?
The molecular formula of N,N-diethylethanethioamide is C6H13NS.
What is the molecular weight of N,N-diethylethanethioamide?
The molecular weight of N,N-diethylethanethioamide is 131.08 g/mol.
Where can I buy N,N-diethylethanethioamide?
You can request a quote for N,N-diethylethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethylethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethylethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.