Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide
TL;DR: Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide (CAS 5339-45-7) is a chemical compound with molecular formula C19H41IN2S and molecular weight 456.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexadecyl N,N'-dimethylcarbamimidothioate;hydroiodide
Also Known As: Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide, Pseudourea,3-dimethyl-2-thio-, hydriodide, 2-Hexadecyl-1,3-dimethyl-2-thiopseudourea hydriodide, Pseudourea,3-dimethyl-2-thio-, monohydriodide, Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, monohydriodide
| Molecular Formula | C19H41IN2S |
|---|---|
| Molecular Weight | 456.20 g/mol |
| LogP | 7.02 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 456.20352 |
| Heavy Atoms | 23 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 5339-45-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCSC(=NC)NC.I |
| InChIKey | IOLFLTFZPJRMLY-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide (CAS 5339-45-7), with molecular formula C19H41IN2S and molecular weight 456.20 g/mol. IUPAC: hexadecyl N,N'-dimethylcarbamimidothioate;hydroiodide.
Chemical Property Profile of Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide
Property Insights of Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide
The XLogP value of 7.02 indicates that Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, 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, Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, 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 Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide?
The CAS number of Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide is 5339-45-7.
What is the molecular formula of Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide?
The molecular formula of Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide is C19H41IN2S.
What is the molecular weight of Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide?
The molecular weight of Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide is 456.20 g/mol.
Where can I buy Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide?
You can request a quote for Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.