2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione
TL;DR: 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione (CAS 4602-37-3) is a chemical compound with molecular formula C11H12N2S and molecular weight 204.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-4-phenyl-1H-imidazole-5-thione
Also Known As: ChemDiv3_008549, 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione, 2,2-dimethyl-4-phenyl-1H-imidazole-5-thione, 2,2-Dimethyl-4-phenyl-1H-imidazole-5(2H)-thione, 2,2-dimethyl-5-phenyl-2,3-dihydro-4H-imidazole-4-thione
| Molecular Formula | C11H12N2S |
|---|---|
| Molecular Weight | 204.07 g/mol |
| LogP | 2.1424 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.07211 |
| Heavy Atoms | 14 |
| Complexity | 393.00836 |
Chemical Identifiers
| CAS Number | 4602-37-3 |
|---|---|
| SMILES | CC1(NC(=S)C(=N1)C2=CC=CC=C2)C |
Product Overview
2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione (CAS 4602-37-3), with molecular formula C11H12N2S and molecular weight 204.07 g/mol. IUPAC: 2,2-dimethyl-4-phenyl-1H-imidazole-5-thione.
Chemical Property Profile of 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione
Property Insights of 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione
The XLogP value of 2.1424 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione. With a topological polar surface area (TPSA) of 24.39 Ų, 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-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 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione?
The CAS number of 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione is 4602-37-3.
What is the molecular formula of 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione?
The molecular formula of 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione is C11H12N2S.
What is the molecular weight of 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione?
The molecular weight of 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione is 204.07 g/mol.
Where can I buy 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione?
You can request a quote for 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 2,2-dimethyl-4-phenyl-2,5-dihydro-1H-imidazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.