N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide
Chemical Structure Depiction of
N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide
N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide
Compound characteristics
| Compound ID: | E157-2712 |
| Compound Name: | N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C22 H26 N4 O3 S2 |
| Smiles: | [H][C@@]12CC3(C[C@@]([H])(C1)C[C@]([H])(C3)C2)C(Nc1nnc(s1)S(N1CCCc2ccccc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2107 |
| logD: | 4.2174 |
| logSw: | -5.4367 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.835 |
| InChI Key: | GRIZILADMSPIJO-UHFFFAOYSA-N |