N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide
Compound characteristics
| Compound ID: | Y030-7128 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylbutanamide |
| Molecular Weight: | 309.82 |
| Molecular Formula: | C14 H16 Cl N3 O S |
| Smiles: | CCC(C)C(Nc1nnc(Cc2ccc(cc2)[Cl])s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1378 |
| logD: | 4.1009 |
| logSw: | -4.3848 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.37 |
| InChI Key: | HXBPKMZXDPJHMI-VIFPVBQESA-N |