2-amidinothio-N-(2,4-dimethylphenyl)acetamide
TL;DR: 2-amidinothio-N-(2,4-dimethylphenyl)acetamide (CAS 669703-71-3) is a chemical compound with molecular formula C11H15N3OS and molecular weight 237.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,4-dimethylanilino)-2-oxoethyl] carbamimidothioate
Also Known As: 2-amidinothio-N-(2,4-dimethylphenyl)acetamide, [2-(2,4-dimethylanilino)-2-oxoethyl] carbamimidothioate, 2-carbamimidoylsulfanyl-N-(2,4-dimethylphenyl)acetamide, 2-[(2,4-dimethylphenyl)amino]-2-oxoethyl imidothiocarbamate hydrochloride
| Molecular Formula | C11H15N3OS |
|---|---|
| Molecular Weight | 237.09 g/mol |
| LogP | 1.86861 |
| Topological Polar Surface Area | 78.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.09358 |
| Heavy Atoms | 16 |
| Complexity | 417.69073 |
Chemical Identifiers
| CAS Number | 669703-71-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC(=N)N)C |
Product Overview
2-amidinothio-N-(2,4-dimethylphenyl)acetamide (CAS 669703-71-3), with molecular formula C11H15N3OS and molecular weight 237.09 g/mol. IUPAC: [2-(2,4-dimethylanilino)-2-oxoethyl] carbamimidothioate.
Chemical Property Profile of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide
Property Insights of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide
The XLogP value of 1.86861 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amidinothio-N-(2,4-dimethylphenyl)acetamide. The TPSA of 78.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amidinothio-N-(2,4-dimethylphenyl)acetamide. Following Lipinski's Rule of Five, 2-amidinothio-N-(2,4-dimethylphenyl)acetamide 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
Frequently Asked Questions
What is the CAS number of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide?
The CAS number of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide is 669703-71-3.
What is the molecular formula of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide?
The molecular formula of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide is C11H15N3OS.
What is the molecular weight of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide?
The molecular weight of 2-amidinothio-N-(2,4-dimethylphenyl)acetamide is 237.09 g/mol.
Where can I buy 2-amidinothio-N-(2,4-dimethylphenyl)acetamide?
You can request a quote for 2-amidinothio-N-(2,4-dimethylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amidinothio-N-(2,4-dimethylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-amidinothio-N-(2,4-dimethylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.