5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide
TL;DR: 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide (CAS 33289-23-5) 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.
5-methyl-3-oxido-4-phenyl-1,5-dihydroimidazol-3-ium-2-thione
Also Known As: 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide, 3-Imidazoline-2-thione, 5-methyl-4-phenyl-, 3-oxide, 5-Methyl-4-phenyl-3-imidazoline-2-thione3-oxide, 5-methyl-3-oxido-4-phenyl-1,5-dihydroimidazol-3-ium-2-thione, 5-methyl-4-phenyl-2-sulfanylidene-2,5-dihydro-1H-imidazol-3-ium-3-olate
| Molecular Formula | C10H10N2OS |
|---|---|
| Molecular Weight | 206.05 g/mol |
| LogP | 1.2626 |
| 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 | 33289-23-5 |
|---|---|
| SMILES | CC1C(=[N+](C(=S)N1)[O-])C2=CC=CC=C2 |
Product Overview
5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide (CAS 33289-23-5), with molecular formula C10H10N2OS and molecular weight 206.05 g/mol. IUPAC: 5-methyl-3-oxido-4-phenyl-1,5-dihydroimidazol-3-ium-2-thione.
Chemical Property Profile of 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide
Property Insights of 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide
The XLogP value of 1.2626 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide. With a topological polar surface area (TPSA) of 38.1 Ų, 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide 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 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide?
The CAS number of 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide is 33289-23-5.
What is the molecular formula of 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide?
The molecular formula of 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide is C10H10N2OS.
What is the molecular weight of 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide?
The molecular weight of 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide is 206.05 g/mol.
Where can I buy 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide?
You can request a quote for 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-4-phenyl-3-imidazoline-2-thione 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.