Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide
TL;DR: Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide (CAS 15260-36-3) is a chemical compound with molecular formula C16H19IN2S and molecular weight 398.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N,N'-dibenzylcarbamimidothioate;hydroiodide
Also Known As: 1,3-Dibenzyl-2-methyl-2-thiopseudourea hydroiodide, Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide, 1,3-Dibenzyl-2-methylthiopseudourea hydroiodide, methyl N,N'-dibenzylcarbamimidothioate hydroiodide, Methyl N,N'-dibenzylcarbamimidothioate--hydrogen iodide (1/1)
| Molecular Formula | C16H19IN2S |
|---|---|
| Molecular Weight | 398.03 g/mol |
| LogP | 4.3134 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.03137 |
| Heavy Atoms | 20 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 15260-36-3 |
|---|---|
| SMILES | CSC(=NCC1=CC=CC=C1)NCC2=CC=CC=C2.I |
| InChIKey | GEOAPWYHHFHBAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide (CAS 15260-36-3), with molecular formula C16H19IN2S and molecular weight 398.03 g/mol. IUPAC: methyl N,N'-dibenzylcarbamimidothioate;hydroiodide.
Chemical Property Profile of Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide
Property Insights of Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide
The XLogP value of 4.3134 indicates that Pseudourea, 1,3-dibenzyl-2-methyl-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, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide has 2 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 Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide?
The CAS number of Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide is 15260-36-3.
What is the molecular formula of Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide?
The molecular formula of Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide is C16H19IN2S.
What is the molecular weight of Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide?
The molecular weight of Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide is 398.03 g/mol.
Where can I buy Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide?
You can request a quote for Pseudourea, 1,3-dibenzyl-2-methyl-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, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 1,3-dibenzyl-2-methyl-2-thio-, hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.