N-{5-[(2-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide
Chemical Structure Depiction of
N-{5-[(2-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide
N-{5-[(2-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide
Compound characteristics
| Compound ID: | 3202-0084 |
| Compound Name: | N-{5-[(2-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide |
| Molecular Weight: | 403.93 |
| Molecular Formula: | C20 H22 Cl N3 O2 S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(Nc1nnc(COc2ccccc2[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6286 |
| logD: | 4.9929 |
| logSw: | -5.9571 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.717 |
| InChI Key: | MSBGGIVSTXKVRY-UHFFFAOYSA-N |