N-{5-[(1,3-benzothiazol-2-yl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbenzamide
Chemical Structure Depiction of
N-{5-[(1,3-benzothiazol-2-yl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbenzamide
N-{5-[(1,3-benzothiazol-2-yl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbenzamide
Compound characteristics
| Compound ID: | C301-7876 |
| Compound Name: | N-{5-[(1,3-benzothiazol-2-yl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbenzamide |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C18 H14 N4 O S2 |
| Smiles: | Cc1ccccc1C(Nc1nnc(Cc2nc3ccccc3s2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.521 |
| logD: | 3.7453 |
| logSw: | -4.3906 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.314 |
| InChI Key: | NKZMEPIBTHXZDJ-UHFFFAOYSA-N |