4-(adamantan-1-yl)-5-methyl-1,3-dihydro-2H-imidazole-2-thione
Chemical Structure Depiction of
4-(adamantan-1-yl)-5-methyl-1,3-dihydro-2H-imidazole-2-thione
4-(adamantan-1-yl)-5-methyl-1,3-dihydro-2H-imidazole-2-thione
Compound characteristics
| Compound ID: | 0KPI-0079 |
| Compound Name: | 4-(adamantan-1-yl)-5-methyl-1,3-dihydro-2H-imidazole-2-thione |
| Molecular Weight: | 248.39 |
| Molecular Formula: | C14 H20 N2 S |
| Smiles: | CC1=C(C23CC4CC(CC(C4)C3)C2)NC(N1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.7794 |
| logD: | 2.7585 |
| logSw: | -4.0573 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 22.2423 |
| InChI Key: | JBTOPOAPBJMCRU-UHFFFAOYSA-N |