Ethyl methyl phenylcarbonodithioimidate
TL;DR: Ethyl methyl phenylcarbonodithioimidate (CAS 22965-07-7) is a chemical compound with molecular formula C10H13NS2 and molecular weight 211.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylsulfanyl-1-methylsulfanyl-N-phenylmethanimine
Also Known As: ethyl methyl phenylcarbonodithioimidate, NCI60_002520, 1-ethylsulfanyl-1-methylsulfanyl-N-phenylmethanimine, 1-Ethylsulfanyl-1-methylsulfanyl-n-phenyl-methanimine
| Molecular Formula | C10H13NS2 |
|---|---|
| Molecular Weight | 211.05 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 63.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.04893 |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 22965-07-7 |
|---|---|
| SMILES | CCSC(=NC1=CC=CC=C1)SC |
| InChIKey | VHHYZVXKUOICQW-UHFFFAOYSA-N |
Product Overview
Ethyl methyl phenylcarbonodithioimidate (CAS 22965-07-7), with molecular formula C10H13NS2 and molecular weight 211.05 g/mol. IUPAC: 1-ethylsulfanyl-1-methylsulfanyl-N-phenylmethanimine.
Chemical Property Profile of Ethyl methyl phenylcarbonodithioimidate
Property Insights of Ethyl methyl phenylcarbonodithioimidate
The XLogP value of 3.8 indicates that Ethyl methyl phenylcarbonodithioimidate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl methyl phenylcarbonodithioimidate. Following Lipinski's Rule of Five, Ethyl methyl phenylcarbonodithioimidate has 0 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 Ethyl methyl phenylcarbonodithioimidate?
The CAS number of Ethyl methyl phenylcarbonodithioimidate is 22965-07-7.
What is the molecular formula of Ethyl methyl phenylcarbonodithioimidate?
The molecular formula of Ethyl methyl phenylcarbonodithioimidate is C10H13NS2.
What is the molecular weight of Ethyl methyl phenylcarbonodithioimidate?
The molecular weight of Ethyl methyl phenylcarbonodithioimidate is 211.05 g/mol.
Where can I buy Ethyl methyl phenylcarbonodithioimidate?
You can request a quote for Ethyl methyl phenylcarbonodithioimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl methyl phenylcarbonodithioimidate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl methyl phenylcarbonodithioimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.