N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methylbenzamide
Chemical Structure Depiction of
N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methylbenzamide
N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methylbenzamide
Compound characteristics
| Compound ID: | Y030-7242 |
| Compound Name: | N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methylbenzamide |
| Molecular Weight: | 289.4 |
| Molecular Formula: | C15 H19 N3 O S |
| Smiles: | Cc1cccc(c1)C(Nc1nnc(CC(C)(C)C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.353 |
| logD: | 3.1359 |
| logSw: | -4.3729 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.37 |
| InChI Key: | IFFHOUXGXNTMNV-UHFFFAOYSA-N |