[(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate
TL;DR: [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate (CAS 66637-32-9) is a chemical compound with molecular formula C7H11N3O3S and molecular weight 217.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate
Also Known As: 3-Methyl-2,5-thiomorpholinedione 2-(O-((methylamino)carbonyl)oxime)
| Molecular Formula | C7H11N3O3S |
|---|---|
| Molecular Weight | 217.05 g/mol |
| LogP | -0.0926 |
| Topological Polar Surface Area | 79.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.05211 |
| Heavy Atoms | 14 |
| Complexity | 279.35358 |
Chemical Identifiers
| CAS Number | 66637-32-9 |
|---|---|
| SMILES | CC1C(=NOC(=O)NC)SCC(=O)N1 |
Product Overview
[(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate (CAS 66637-32-9), with molecular formula C7H11N3O3S and molecular weight 217.05 g/mol. IUPAC: [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate.
Chemical Property Profile of [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate
Property Insights of [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate
The XLogP value of -0.0926 indicates that [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.79 Ų falls within the moderate polarity range, balancing permeability and solubility for [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate. Following Lipinski's Rule of Five, [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate has 2 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 [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate?
The CAS number of [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate is 66637-32-9.
What is the molecular formula of [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate?
The molecular formula of [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate is C7H11N3O3S.
What is the molecular weight of [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate?
The molecular weight of [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate is 217.05 g/mol.
Where can I buy [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate?
You can request a quote for [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [(3-methyl-5-oxothiomorpholin-2-ylidene)amino] N-methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.