3-(2-chlorophenyl)-5-methyl-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-5-methyl-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide
3-(2-chlorophenyl)-5-methyl-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide
Compound characteristics
Compound ID: | Y031-0437 |
Compound Name: | 3-(2-chlorophenyl)-5-methyl-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide |
Molecular Weight: | 390.89 |
Molecular Formula: | C18 H19 Cl N4 O2 S |
Smiles: | CCCC(C)c1nnc(NC(c2c(c3ccccc3[Cl])noc2C)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.785 |
logD: | 3.9394 |
logSw: | -4.9816 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.835 |
InChI Key: | ZYQGJWCQJBIZMV-JTQLQIEISA-N |