TL;DR: [(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate (CAS 106231-34-9) is a chemical compound with molecular formula C8H14N2O3S and molecular weight 218.07251 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate
Also Known As: 2-Ethyl-5-methyl-1,3-oxathiolan-4-one O-((methylamino)carbonyl)oxime
| Molecular Formula | C8H14N2O3S |
| Molecular Weight | 218.07251 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 85.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.07251 Da |
| Heavy Atoms | 14 |
| Complexity | 245.0 |
| SMILES | CCC1OC(C(=NOC(=O)NC)S1)C |
| InChIKey | WNZYUVSDESQQME-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate. Following Lipinski's Rule of Five, [(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate 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 [(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate is 106231-34-9.
The molecular formula of [(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate is C8H14N2O3S.
The molecular weight of [(2-ethyl-5-methyl-1,3-oxathiolan-4-ylidene)amino] N-methylcarbamate is 218.07251 g/mol.
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