5-Aminopentyl carbamimidothioate
TL;DR: 5-Aminopentyl carbamimidothioate (CAS 98961-99-0) is a chemical compound with molecular formula C6H15N3S and molecular weight 161.09866 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-aminopentyl carbamimidothioate
Also Known As: 5-aminopentyl carbamimidothioate, 5-aminopentylsulfanylmethanimidamide, Pseudourea, 2-(5-aminopentyl)-2-thio-
Technical Specifications
| Molecular Formula | C6H15N3S |
| Molecular Weight | 161.09866 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 161.09866 Da |
| Heavy Atoms | 10 |
| Complexity | 95.0 |
| SMILES | C(CCN)CCSC(=N)N |
| InChIKey | PRQXRGDWKNWLRS-UHFFFAOYSA-N |
Chemical Property Profile of 5-Aminopentyl carbamimidothioate
Property Insights of 5-Aminopentyl carbamimidothioate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Aminopentyl carbamimidothioate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Aminopentyl carbamimidothioate. Following Lipinski's Rule of Five, 5-Aminopentyl 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 5-Aminopentyl carbamimidothioate?
The CAS number of 5-Aminopentyl carbamimidothioate is 98961-99-0.
What is the molecular formula of 5-Aminopentyl carbamimidothioate?
The molecular formula of 5-Aminopentyl carbamimidothioate is C6H15N3S.
What is the molecular weight of 5-Aminopentyl carbamimidothioate?
The molecular weight of 5-Aminopentyl carbamimidothioate is 161.09866 g/mol.
Where can I buy 5-Aminopentyl carbamimidothioate?
You can request a quote for 5-Aminopentyl carbamimidothioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Aminopentyl carbamimidothioate?
Yes, CoreyChem provides custom synthesis services for 5-Aminopentyl carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.