5-[(3,5-dimethylphenoxy)methyl]-N-[3-(4-ethylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(3,5-dimethylphenoxy)methyl]-N-[3-(4-ethylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
5-[(3,5-dimethylphenoxy)methyl]-N-[3-(4-ethylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F912-0686 |
| Compound Name: | 5-[(3,5-dimethylphenoxy)methyl]-N-[3-(4-ethylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C25 H29 N5 O3 S |
| Smiles: | CCN1CCN(CC1)C(c1cccc(c1)NC(c1nnc(COc2cc(C)cc(C)c2)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4543 |
| logD: | 3.278 |
| logSw: | -3.6253 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.742 |
| InChI Key: | CPQHEYJWOYBLAK-UHFFFAOYSA-N |