N-{5-[(4-bromophenoxy)methyl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide
Chemical Structure Depiction of
N-{5-[(4-bromophenoxy)methyl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide
N-{5-[(4-bromophenoxy)methyl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 3202-0027 |
| Compound Name: | N-{5-[(4-bromophenoxy)methyl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide |
| Molecular Weight: | 396.3 |
| Molecular Formula: | C16 H18 Br N3 O2 S |
| Smiles: | C1CCC(CC1)C(Nc1nnc(COc2ccc(cc2)[Br])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5636 |
| logD: | 4.2243 |
| logSw: | -4.3354 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.79 |
| InChI Key: | LSKUYAXHZISIFZ-UHFFFAOYSA-N |