N-[1-(adamantan-1-yl)butyl]-N'-[(oxolan-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)butyl]-N'-[(oxolan-2-yl)methyl]thiourea
N-[1-(adamantan-1-yl)butyl]-N'-[(oxolan-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | Y503-3999 |
| Compound Name: | N-[1-(adamantan-1-yl)butyl]-N'-[(oxolan-2-yl)methyl]thiourea |
| Molecular Weight: | 350.57 |
| Molecular Formula: | C20 H34 N2 O S |
| Smiles: | CCCC(C12CC3CC(CC(C3)C2)C1)NC(NCC1CCCO1)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2801 |
| logD: | 4.2801 |
| logSw: | -4.1839 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 30.0232 |
| InChI Key: | HXGHHMVEEJLYLB-UHFFFAOYSA-N |