N-[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide
Chemical Structure Depiction of
N-[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide
N-[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide
Compound characteristics
| Compound ID: | 8008-8127 |
| Compound Name: | N-[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide |
| Molecular Weight: | 330.23 |
| Molecular Formula: | C13 H13 Cl2 N3 O S |
| Smiles: | CC(C)CC(Nc1nnc(c2ccc(cc2[Cl])[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6693 |
| logD: | 4.6658 |
| logSw: | -4.8924 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.661 |
| InChI Key: | CEWISSOMPPKNKS-UHFFFAOYSA-N |