Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide
TL;DR: Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide (CAS 33499-11-5) is a chemical compound with molecular formula C10H15IN2S and molecular weight 322.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-(2,6-dimethylphenyl)carbamimidothioate;hydroiodide
Also Known As: N-(2,6-dimethylphenyl)(methylsulfanyl)methanimidamide hydroiodide, Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide, 2-Methyl-2-thio-3-(2,6-xylyl)pseudourea hydriodide, 1-(2,6-Xylyl)-2-methyl-2-thiopseudourea hydroiodide, methyl N'-(2,6-dimethylphenyl)carbamimidothioate;hydroiodide
| Molecular Formula | C10H15IN2S |
|---|---|
| Molecular Weight | 322.00 g/mol |
| LogP | 3.23064 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.00006 |
| Heavy Atoms | 14 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 33499-11-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N=C(N)SC.I |
| InChIKey | NASYPFBRLFJLSO-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide (CAS 33499-11-5), with molecular formula C10H15IN2S and molecular weight 322.00 g/mol. IUPAC: methyl N'-(2,6-dimethylphenyl)carbamimidothioate;hydroiodide.
Chemical Property Profile of Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide
Property Insights of Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide
The XLogP value of 3.23064 indicates that Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide. Following Lipinski's Rule of Five, Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, 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, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide?
The CAS number of Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide is 33499-11-5.
What is the molecular formula of Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide?
The molecular formula of Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide is C10H15IN2S.
What is the molecular weight of Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide?
The molecular weight of Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide is 322.00 g/mol.
Where can I buy Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide?
You can request a quote for Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, 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-methyl-2-thio-3-(2,6-xylyl)-, hydriodide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.