4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione
TL;DR: 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione (CAS 890091-92-6) is a chemical compound with molecular formula C8H14N2S and molecular weight 170.08777 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butyl-5-methyl-1,3-dihydroimidazole-2-thione
Also Known As: ZERO/004699, 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione, 4-butyl-5-methyl-1,3-dihydroimidazole-2-thione, 4-butyl-5-methyl-4-imidazoline-2-thione, 4-butyl-5-methyl-2,3-dihydro-1H-imidazole-2-thione
Technical Specifications
| Molecular Formula | C8H14N2S |
| Molecular Weight | 170.08777 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.08777 Da |
| Heavy Atoms | 11 |
| Complexity | 196.0 |
| SMILES | CCCCC1=C(NC(=S)N1)C |
| InChIKey | FEYSTHNDFVQQSD-UHFFFAOYSA-N |
Chemical Property Profile of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione
Property Insights of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione. With a topological polar surface area (TPSA) of 56.2 Ų, 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione?
The CAS number of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione is 890091-92-6.
What is the molecular formula of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione?
The molecular formula of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione is C8H14N2S.
What is the molecular weight of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione?
The molecular weight of 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione is 170.08777 g/mol.
Where can I buy 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione?
You can request a quote for 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione?
Yes, CoreyChem provides custom synthesis services for 4-butyl-5-methyl-1,3-dihydro-2H-imidazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.