4-(adamantan-1-yl)-1,3-thiazol-2(3H)-one
Chemical Structure Depiction of
4-(adamantan-1-yl)-1,3-thiazol-2(3H)-one
4-(adamantan-1-yl)-1,3-thiazol-2(3H)-one
Compound characteristics
| Compound ID: | 0KPI-0081 |
| Compound Name: | 4-(adamantan-1-yl)-1,3-thiazol-2(3H)-one |
| Molecular Weight: | 235.35 |
| Molecular Formula: | C13 H17 N O S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C1=CSC(N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9211 |
| logD: | 2.4604 |
| logSw: | -4.0353 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.5049 |
| InChI Key: | NJUPISSXOJDAHF-UHFFFAOYSA-N |