2-(4-chlorophenyl)-5-(4'-pentyl[1,1'-biphenyl]-4-yl)-1,3,4-thiadiazole
Chemical Structure Depiction of
2-(4-chlorophenyl)-5-(4'-pentyl[1,1'-biphenyl]-4-yl)-1,3,4-thiadiazole
2-(4-chlorophenyl)-5-(4'-pentyl[1,1'-biphenyl]-4-yl)-1,3,4-thiadiazole
Compound characteristics
| Compound ID: | 0630-0059 |
| Compound Name: | 2-(4-chlorophenyl)-5-(4'-pentyl[1,1'-biphenyl]-4-yl)-1,3,4-thiadiazole |
| Molecular Weight: | 418.99 |
| Molecular Formula: | C25 H23 Cl N2 S |
| Smiles: | CCCCCc1ccc(cc1)c1ccc(cc1)c1nnc(c2ccc(cc2)[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 9.0687 |
| logD: | 9.0687 |
| logSw: | -6.8644 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 22.9278 |
| InChI Key: | CKJHWZFHWJGMDT-UHFFFAOYSA-N |