4-(2,4-dichlorophenoxy)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]butanamide
Chemical Structure Depiction of
4-(2,4-dichlorophenoxy)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]butanamide
4-(2,4-dichlorophenoxy)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | Y030-8728 |
| Compound Name: | 4-(2,4-dichlorophenoxy)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]butanamide |
| Molecular Weight: | 402.34 |
| Molecular Formula: | C17 H21 Cl2 N3 O2 S |
| Smiles: | CCC(CC)c1nnc(NC(CCCOc2ccc(cc2[Cl])[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.134 |
| logD: | 5.0519 |
| logSw: | -5.5817 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.166 |
| InChI Key: | OHXFBMZABJMCBH-UHFFFAOYSA-N |