4-tert-butyl-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
4-tert-butyl-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | 2237-0161 |
| Compound Name: | 4-tert-butyl-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 385.91 |
| Molecular Formula: | C20 H20 Cl N3 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nnc(Cc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1257 |
| logD: | 5.7666 |
| logSw: | -6.2674 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.098 |
| InChI Key: | TXXCSQKLRCMJLK-UHFFFAOYSA-N |