4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione
TL;DR: 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione (CAS 33401-33-1) is a chemical compound with molecular formula C10H10N2OS and molecular weight 206.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione
Also Known As: 3-Imidazoline-2-thione, 4-methyl-5-phenyl-, 3-oxide, 4-Methyl-5-phenyl-3-imidazoline-2-thione3-oxide, 4-Methyl-5-phenyl-3-imidazoline-2-thione 3-oxide, 4-methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione, 4-methyl-5-phenyl-2-sulfanylidene-2,5-dihydro-1H-imidazol-3-ium-3-olate
| Molecular Formula | C10H10N2OS |
|---|---|
| Molecular Weight | 206.05 g/mol |
| LogP | 1.587 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.05139 |
| Heavy Atoms | 14 |
| Complexity | 399.84283 |
Chemical Identifiers
| CAS Number | 33401-33-1 |
|---|---|
| SMILES | CC1=[N+](C(=S)NC1C2=CC=CC=C2)[O-] |
Product Overview
4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione (CAS 33401-33-1), with molecular formula C10H10N2OS and molecular weight 206.05 g/mol. IUPAC: 4-methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione.
Chemical Property Profile of 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione
Property Insights of 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione
The XLogP value of 1.587 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione. With a topological polar surface area (TPSA) of 38.1 Ų, 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione has 1 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 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione?
The CAS number of 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione is 33401-33-1.
What is the molecular formula of 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione?
The molecular formula of 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione is C10H10N2OS.
What is the molecular weight of 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione?
The molecular weight of 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione is 206.05 g/mol.
Where can I buy 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione?
You can request a quote for 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-3-oxido-5-phenyl-1,5-dihydroimidazol-3-ium-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.