TL;DR: 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn- (CAS 106358-90-1) is a chemical compound with molecular formula C7H12N2O3S and molecular weight 204.05687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(Z)-(2-methyl-1,4-oxathian-3-ylidene)amino] N-methylcarbamate
Also Known As: syn-2-Methyl-1,4-oxathian-3-one O-((methylamino)carbonyl)oxime, 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn-, [(Z)-(2-methyl-1,4-oxathian-3-ylidene)amino] N-methylcarbamate
| Molecular Formula | C7H12N2O3S |
| Molecular Weight | 204.05687 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 85.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.05687 Da |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
| SMILES | CC1/C(=N/OC(=O)NC)/SCCO1 |
| InChIKey | WUPFZGYQHXOTQH-TWGQIWQCSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn-. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn-. Following Lipinski's Rule of Five, 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn- is 106358-90-1.
The molecular formula of 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn- is C7H12N2O3S.
The molecular weight of 1,4-Oxathian-3-one, 2-methyl-, O-((methylamino)carbonyl)oxime, syn- is 204.05687 g/mol.
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