(3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
TL;DR: (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone (CAS 851863-06-4) is a chemical compound with molecular formula C13H16N2OS and molecular weight 248.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethylphenyl)-(2-methylsulfanyl-4,5-dihydroimidazol-1-yl)methanone
Also Known As: F0630-0012, (3,5-dimethylphenyl)-(2-methylsulfanyl-4,5-dihydroimidazol-1-yl)methanone, (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
| Molecular Formula | C13H16N2OS |
|---|---|
| Molecular Weight | 248.10 g/mol |
| LogP | 2.47824 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.09833 |
| Heavy Atoms | 17 |
| Complexity | 462.05786 |
Chemical Identifiers
| CAS Number | 851863-06-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)C(=O)N2CCN=C2SC)C |
Product Overview
(3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone (CAS 851863-06-4), with molecular formula C13H16N2OS and molecular weight 248.10 g/mol. IUPAC: (3,5-dimethylphenyl)-(2-methylsulfanyl-4,5-dihydroimidazol-1-yl)methanone.
Chemical Property Profile of (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
Property Insights of (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
The XLogP value of 2.47824 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone. With a topological polar surface area (TPSA) of 32.67 Ų, (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone has 0 hydrogen bond donor(s) and 3 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 (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
The CAS number of (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone is 851863-06-4.
What is the molecular formula of (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
The molecular formula of (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone is C13H16N2OS.
What is the molecular weight of (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
The molecular weight of (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone is 248.10 g/mol.
Where can I buy (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
You can request a quote for (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3,5-dimethylphenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.