1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide
TL;DR: 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide (CAS 1052405-94-3) is a chemical compound with molecular formula C11H14IN3S and molecular weight 346.99533 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-ethylindol-3-yl) carbamimidothioate;hydroiodide
Also Known As: 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide, 2-(1-ethylindol-3-yl)isothiourea;hydroiodide, [(1-ethyl-1H-indol-3-yl)sulfanyl]methanimidamide hydroiodide, (1-ethylindol-3-yl) carbamimidothioate hydroiodide, (1-ethylindol-3-yl) carbamimidothioate;hydroiodide
Technical Specifications
| Molecular Formula | C11H14IN3S |
| Molecular Weight | 346.99533 g/mol |
| XLogP | 3.26477 |
| Topological Polar Surface Area (TPSA) | 80.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.99533 Da |
| Heavy Atoms | 16 |
| Complexity | 244.0 |
| SMILES | CCN1C=C(C2=CC=CC=C21)SC(=N)N.I |
| InChIKey | BRMQHUYORJSJHI-UHFFFAOYSA-N |
Chemical Property Profile of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide
Property Insights of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide
The XLogP value of 3.26477 indicates that 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide. Following Lipinski's Rule of Five, 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide?
The CAS number of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide is 1052405-94-3.
What is the molecular formula of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide?
The molecular formula of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide is C11H14IN3S.
What is the molecular weight of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide?
The molecular weight of 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide is 346.99533 g/mol.
Where can I buy 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide?
You can request a quote for 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide?
Yes, CoreyChem provides custom synthesis services for 1-ethyl-1H-indol-3-yl carbamimidothioate hydroiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.