N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide
Compound characteristics
| Compound ID: | 8008-7609 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide |
| Molecular Weight: | 295.79 |
| Molecular Formula: | C13 H14 Cl N3 O S |
| Smiles: | CCCC(Nc1nnc(Cc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5868 |
| logD: | 3.5657 |
| logSw: | -3.9388 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.156 |
| InChI Key: | QPVSDGIAXFALKT-UHFFFAOYSA-N |