TL;DR: Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)- (CAS 125515-28-8) is a chemical compound with molecular formula C11H24N2O2S and molecular weight 248.15585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(6-methylsulfinylhexyl)-3-propan-2-ylurea
Also Known As: N-isopropyl-N'-(6-methylsulfinylhexyl)urea, 1-(6-methylsulfinylhexyl)-3-propan-2-ylurea, 1-isopropyl-3-(6-(methylsulfinyl)hexyl)urea, Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)-, 3-(6-methanesulfinylhexyl)-1-(propan-2-yl)urea
| Molecular Formula | C11H24N2O2S |
| Molecular Weight | 248.15585 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 77.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 248.15585 Da |
| Heavy Atoms | 16 |
| Complexity | 220.0 |
| SMILES | CC(C)NC(=O)NCCCCCCS(=O)C |
| InChIKey | WUJKEABPANBOBA-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)-. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)-. Following Lipinski's Rule of Five, Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)- is 125515-28-8.
The molecular formula of Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)- is C11H24N2O2S.
The molecular weight of Urea, N-isopropyl-N'-(6-methylsulfinylhexyl)- is 248.15585 g/mol.
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