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methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
TL;DR: methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate (CAS 75089-07-5) is a chemical compound with molecular formula C6H12N2O3S and molecular weight 192.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
Also Known As: methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate, Ethanimidothioic acid, N-((((hydroxymethyl)methylamino)carbonyl)oxy)-,methyl ester, Ethanimidothioic acid, N-[[[(hydroxymethyl)methylamino]carbonyl]oxy]-, methyl ester, methyl (1E)-N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
| Molecular Formula | C6H12N2O3S |
|---|---|
| Molecular Weight | 192.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 87.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.05687 |
| Heavy Atoms | 12 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 75089-07-5 |
|---|---|
| SMILES | CC(=NOC(=O)N(C)CO)SC |
| InChIKey | LRYXRVLBGBJMCM-UHFFFAOYSA-N |
Product Overview
methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate (CAS 75089-07-5), with molecular formula C6H12N2O3S and molecular weight 192.06 g/mol. IUPAC: methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate.
Chemical Property Profile of methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
Property Insights of methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate. The TPSA of 87.4 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate. Following Lipinski's Rule of Five, methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate has 1 hydrogen bond donor(s) and 5 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 methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate?
The CAS number of methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate is 75089-07-5.
What is the molecular formula of methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate?
The molecular formula of methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate is C6H12N2O3S.
What is the molecular weight of methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate?
The molecular weight of methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate is 192.06 g/mol.
Where can I buy methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate?
You can request a quote for methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.