N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3,3-dimethylbutanamide
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | Y030-8918 |
| Compound Name: | N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3,3-dimethylbutanamide |
| Molecular Weight: | 339.84 |
| Molecular Formula: | C15 H18 Cl N3 O2 S |
| Smiles: | CC(C)(C)CC(Nc1nnc(COc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2746 |
| logD: | 3.965 |
| logSw: | -4.4897 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.655 |
| InChI Key: | QHSBRCRIMCTAKY-UHFFFAOYSA-N |