2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide
TL;DR: 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide (CAS 5394-72-9) is a chemical compound with molecular formula C17H37IN2S and molecular weight 428.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecyl N,N'-diethylcarbamimidothioate;hydroiodide
Also Known As: 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide, Pseudourea,3-diethyl-2-thio-, hydriodide, Pseudourea, 2-dodecyl-1,3-diethyl-2-thio-, hydriodide, Pseudourea, 2-dodecyl-1,3-diethyl-2-thio-, monohydriodide, Pseudourea,3-diethyl-2-thio-, monohydriodide
| Molecular Formula | C17H37IN2S |
|---|---|
| Molecular Weight | 428.17 g/mol |
| LogP | 6.24 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 428.1722 |
| Heavy Atoms | 21 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 5394-72-9 |
|---|---|
| SMILES | CCCCCCCCCCCCSC(=NCC)NCC.I |
| InChIKey | BQKNKIBSGQFMOH-UHFFFAOYSA-N |
Product Overview
2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide (CAS 5394-72-9), with molecular formula C17H37IN2S and molecular weight 428.17 g/mol. IUPAC: dodecyl N,N'-diethylcarbamimidothioate;hydroiodide.
Chemical Property Profile of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide
Property Insights of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide
The XLogP value of 6.24 indicates that 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide?
The CAS number of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide is 5394-72-9.
What is the molecular formula of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide?
The molecular formula of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide is C17H37IN2S.
What is the molecular weight of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide?
The molecular weight of 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide is 428.17 g/mol.
Where can I buy 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide?
You can request a quote for 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide?
Yes, KEHONG BIO provides custom synthesis services for 2-Dodecyl-1,3-diethyl-2-thiopseudourea hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.