TL;DR: [(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate (CAS 106231-46-3) is a chemical compound with molecular formula C6H10N2O2S2 and molecular weight 206.01837 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(Z)-(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate
Also Known As: J1.552.844C, [(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate, 5-Methyl-1,3-dithiolane-4-one (Z)-O-(methylcarbamoyl)oxime, [(4Z)-5-methyl-1,3-dithiolan-4-ylidene]amino N-methylcarbamate, [(Z)-(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate
| Molecular Formula | C6H10N2O2S2 |
| Molecular Weight | 206.01837 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.01837 Da |
| Heavy Atoms | 12 |
| Complexity | 208.0 |
| SMILES | CC1/C(=N/OC(=O)NC)/SCS1 |
| InChIKey | XBGUTAISSLTGIB-YVMONPNESA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate. Following Lipinski's Rule of Five, [(5-methyl-1,3-dithiolan-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 [(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate is 106231-46-3.
The molecular formula of [(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate is C6H10N2O2S2.
The molecular weight of [(5-methyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate is 206.01837 g/mol.
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