![2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea structure](/static/products/9298/92988-71-1.webp)
2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea
TL;DR: 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea (CAS 92988-71-1) is a chemical compound with molecular formula C9H21N7S3 and molecular weight 323.10205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[bis(2-carbamimidoylsulfanylethyl)amino]ethyl carbamimidothioate
Also Known As: tri-(2-Thioureido-ethyl)-amine, nitrilotriethane-2,1-diyl tricarbamimidothioate, 2-[2-[bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea, 2-[bis(2-carbamimidoylsulfanylethyl)amino]ethyl carbamimidothioate, 2-(bis(2-carbamimidoylsulfanylethyl)amino)ethylsulfanylmethanimidamide
Technical Specifications
| Molecular Formula | C9H21N7S3 |
| Molecular Weight | 323.10205 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 229.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 323.10205 Da |
| Heavy Atoms | 19 |
| Complexity | 263.0 |
| SMILES | C(CSC(=N)N)N(CCSC(=N)N)CCSC(=N)N |
| InChIKey | GGDUORJVTMUGNU-UHFFFAOYSA-N |
Chemical Property Profile of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea
Property Insights of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea. The TPSA of 229.0 Ų indicates high polarity, suggesting 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea?
The CAS number of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea is 92988-71-1.
What is the molecular formula of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea?
The molecular formula of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea is C9H21N7S3.
What is the molecular weight of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea?
The molecular weight of 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea is 323.10205 g/mol.
Where can I buy 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea?
You can request a quote for 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea?
Yes, CoreyChem provides custom synthesis services for 2-[2-[Bis(2-carbamimidoylsulfanylethyl)amino]ethyl]isothiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.