5-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L076-1079 |
Compound Name: | 5-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 444.91 |
Molecular Formula: | C21 H18 Cl F N4 O2 S |
Smiles: | C1CN(CCC1c1nnc(C(Nc2ccccc2F)=O)s1)C(c1ccccc1[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.5064 |
logD: | 3.5031 |
logSw: | -4.0482 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.513 |
InChI Key: | JAKXBFPUSUHTOK-UHFFFAOYSA-N |