N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide
TL;DR: N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide (CAS 132944-54-8) is a chemical compound with molecular formula C9H12IN3S and molecular weight 320.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-[(E)-benzylideneamino]carbamimidothioate;hydroiodide
Also Known As: N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide, Hydrazinecarboximidothioic acid, 2-(phenylmethylene)-, methyl ester, hydriodide (1:1)
| Molecular Formula | C9H12IN3S |
|---|---|
| Molecular Weight | 320.98 g/mol |
| LogP | 2.3162 |
| Topological Polar Surface Area | 50.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.97968 |
| Heavy Atoms | 14 |
| Complexity | 311.09293 |
Chemical Identifiers
| CAS Number | 132944-54-8 |
|---|---|
| SMILES | CS/C(=N/N=C/C1=CC=CC=C1)/N.I |
Product Overview
N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide (CAS 132944-54-8), with molecular formula C9H12IN3S and molecular weight 320.98 g/mol. IUPAC: methyl N'-[(E)-benzylideneamino]carbamimidothioate;hydroiodide.
Chemical Property Profile of N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide
Property Insights of N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide
The XLogP value of 2.3162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide. With a topological polar surface area (TPSA) of 50.74 Ų, N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide has 1 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 N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide?
The CAS number of N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide is 132944-54-8.
What is the molecular formula of N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide?
The molecular formula of N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide is C9H12IN3S.
What is the molecular weight of N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide?
The molecular weight of N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide is 320.98 g/mol.
Where can I buy N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide?
You can request a quote for N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide?
Yes, KEHONG BIO provides custom synthesis services for N'-(benzylideneamino)-1-methylsulfanyl-methanimidamide Hydroiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.