N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-methylbutanamide
Chemical Structure Depiction of
N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-methylbutanamide
N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-methylbutanamide
Compound characteristics
| Compound ID: | 8009-2577 |
| Compound Name: | N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-methylbutanamide |
| Molecular Weight: | 347.48 |
| Molecular Formula: | C18 H25 N3 O2 S |
| Smiles: | CC(C)CC(Nc1nnc(COc2ccc(cc2)C(C)(C)C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0406 |
| logD: | 4.8198 |
| logSw: | -4.5267 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.655 |
| InChI Key: | BMRUOQRGUNHWSC-UHFFFAOYSA-N |