TL;DR: 5-(1-Ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione (CAS 67051-03-0) is a chemical compound with molecular formula C14H24N2O3S and molecular weight 300.15076 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(1-ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-(1-ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione, 5-[1- ethyl]-5-hexyl-2-sodiooxy-4,6 -pyrimidinedione, 5-[1-(ethylsulfanyl)ethyl]-5-hexylpyrimidine-2,4,6(1h,3h,5h)-trione
| Molecular Formula | C14H24N2O3S |
| Molecular Weight | 300.15076 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 300.15076 Da |
| Heavy Atoms | 20 |
| Complexity | 365.0 |
| SMILES | CCCCCCC1(C(=O)NC(=O)NC1=O)C(C)SCC |
| InChIKey | JGQCCQOSPIMRRX-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 5-(1-Ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(1-Ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-(1-Ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(1-Ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione is 67051-03-0.
The molecular formula of 5-(1-Ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione is C14H24N2O3S.
The molecular weight of 5-(1-Ethylsulfanylethyl)-5-hexyl-1,3-diazinane-2,4,6-trione is 300.15076 g/mol.
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