Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride
TL;DR: Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride (CAS 73840-07-0) is a chemical compound with molecular formula C7H17ClN2S2 and molecular weight 228.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentylsulfanylmethyl carbamimidothioate;hydrochloride
Also Known As: S-(n-Amylthiomethyl)isothiuronium hydrochloride, Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride, 2-(Pentylthiomethyl)-2-thiopseudourea hydrochloride, pentylsulfanylmethyl carbamimidothioate hydrochloride, (Pentylsulfanyl)methyl carbamimidothioate--hydrogen chloride (1/1)
| Molecular Formula | C7H17ClN2S2 |
|---|---|
| Molecular Weight | 228.05 g/mol |
| LogP | 2.91577 |
| Topological Polar Surface Area | 49.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 228.05217 |
| Heavy Atoms | 12 |
| Complexity | 111.5795 |
Chemical Identifiers
| CAS Number | 73840-07-0 |
|---|---|
| SMILES | CCCCCSCSC(=N)N.Cl |
Product Overview
Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride (CAS 73840-07-0), with molecular formula C7H17ClN2S2 and molecular weight 228.05 g/mol. IUPAC: pentylsulfanylmethyl carbamimidothioate;hydrochloride.
Chemical Property Profile of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride
Property Insights of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride
The XLogP value of 2.91577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride. With a topological polar surface area (TPSA) of 49.87 Ų, Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride?
The CAS number of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride is 73840-07-0.
What is the molecular formula of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride?
The molecular formula of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride is C7H17ClN2S2.
What is the molecular weight of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride?
The molecular weight of Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride is 228.05 g/mol.
Where can I buy Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride?
You can request a quote for Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-(pentylthiomethyl)-2-thio-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.