N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylphenoxy)butanamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylphenoxy)butanamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylphenoxy)butanamide
Compound characteristics
| Compound ID: | 4112-1771 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylphenoxy)butanamide |
| Molecular Weight: | 401.91 |
| Molecular Formula: | C20 H20 Cl N3 O2 S |
| Smiles: | Cc1ccccc1OCCCC(Nc1nnc(Cc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9136 |
| logD: | 4.8926 |
| logSw: | -4.8795 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.389 |
| InChI Key: | NQXRBJCHVUICTB-UHFFFAOYSA-N |