Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride
TL;DR: Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride (CAS 64039-37-8) is a chemical compound with molecular formula C11H22Cl2N4O2S2 and molecular weight 376.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(N'-acetylcarbamimidoyl)sulfanylpentyl N'-acetylcarbamimidothioate;dihydrochloride
Also Known As: Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride, 2,2'-Pentamethylene-bis(1-acetyl-2-thiopseudourea), dihydrochloride, Pseudourea, 2,2'-pentamethylenebis(1-acetyl-2-thio-, dihydrochloride, pentane-1,5-diyl bis(n'-acetylcarbamimidothioate) dihydrochloride, 5-(N'-acetylcarbamimidoyl)sulfanylpentyl N'-acetylcarbamimidothioate dihydrochloride
| Molecular Formula | C11H22Cl2N4O2S2 |
|---|---|
| Molecular Weight | 376.06 g/mol |
| LogP | 2.19 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 376.05612 |
| Heavy Atoms | 21 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 64039-37-8 |
|---|---|
| SMILES | CC(=O)N=C(N)SCCCCCSC(=NC(=O)C)N.Cl.Cl |
| InChIKey | HVMPAEGDNBBCGN-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride (CAS 64039-37-8), with molecular formula C11H22Cl2N4O2S2 and molecular weight 376.06 g/mol. IUPAC: 5-(N'-acetylcarbamimidoyl)sulfanylpentyl N'-acetylcarbamimidothioate;dihydrochloride.
Chemical Property Profile of Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride
Property Insights of Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride
The XLogP value of 2.19 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride. The TPSA of 162.0 Ų indicates high polarity, suggesting Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride has 4 hydrogen bond donor(s) and 4 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, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride?
The CAS number of Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride is 64039-37-8.
What is the molecular formula of Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride?
The molecular formula of Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride is C11H22Cl2N4O2S2.
What is the molecular weight of Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride?
The molecular weight of Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride is 376.06 g/mol.
Where can I buy Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride?
You can request a quote for Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2,2'-pentamethylenedithiobis(1-acetyl-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.