N-{5-[ethyl(3-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide
Chemical Structure Depiction of
N-{5-[ethyl(3-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide
N-{5-[ethyl(3-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide
Compound characteristics
| Compound ID: | E157-6054 |
| Compound Name: | N-{5-[ethyl(3-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}adamantane-1-carboxamide |
| Molecular Weight: | 460.62 |
| Molecular Formula: | C22 H28 N4 O3 S2 |
| Smiles: | [H][C@@]12CC3(C[C@@]([H])(C1)C[C@]([H])(C3)C2)C(Nc1nnc(s1)S(N(CC)c1cccc(C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8716 |
| logD: | 4.8783 |
| logSw: | -5.4604 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.233 |
| InChI Key: | BTOUHZDHGPICAB-UHFFFAOYSA-N |