N-(4-methylpiperazine-1-carbothioyl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(4-methylpiperazine-1-carbothioyl)adamantane-1-carboxamide
N-(4-methylpiperazine-1-carbothioyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | 8016-9686 |
| Compound Name: | N-(4-methylpiperazine-1-carbothioyl)adamantane-1-carboxamide |
| Molecular Weight: | 321.48 |
| Molecular Formula: | C17 H27 N3 O S |
| Smiles: | CN1CCN(CC1)C(NC(C12CC3CC(CC(C3)C2)C1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.0941 |
| logD: | 2.2991 |
| logSw: | -3.3344 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.8254 |
| InChI Key: | GXIGPDZGDQNIQA-UHFFFAOYSA-N |