2-(1H-Imidazol-5-yl)ethyl carbamimidothioate
TL;DR: 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate (CAS 102203-18-9) is a chemical compound with molecular formula C6H10N4S and molecular weight 170.06262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1H-imidazol-5-yl)ethyl carbamimidothioate
Also Known As: imetit, Imetit dihydrobromide, Imetit (dihydrobromide), 2-(1h-imidazol-5-yl)ethyl carbamimidothioate, Lopac-I-135
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H10N4S |
| Molecular Weight | 170.06262 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.06262 Da |
| Heavy Atoms | 11 |
| Complexity | 139.0 |
| SMILES | C1=C(NC=N1)CCSC(=N)N |
| InChIKey | PEHSVUKQDJULKE-UHFFFAOYSA-N |
Chemical Property Profile of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate
Property Insights of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate. Following Lipinski's Rule of Five, 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate?
The CAS number of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate is 102203-18-9.
What is the molecular formula of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate?
The molecular formula of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate is C6H10N4S.
What is the molecular weight of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate?
The molecular weight of 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate is 170.06262 g/mol.
Where can I buy 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate?
You can request a quote for 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate?
Yes, CoreyChem provides custom synthesis services for 2-(1H-Imidazol-5-yl)ethyl carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.