N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide
Compound characteristics
| Compound ID: | 8008-7613 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide |
| Molecular Weight: | 295.79 |
| Molecular Formula: | C13 H14 Cl N3 O S |
| Smiles: | CC(C)C(Nc1nnc(Cc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7502 |
| logD: | 3.7263 |
| logSw: | -4.2353 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.37 |
| InChI Key: | NPKMHQGOIGPSPL-UHFFFAOYSA-N |