N-[2-(4-chlorophenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
N-[2-(4-chlorophenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-0147 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide |
| Molecular Weight: | 440.97 |
| Molecular Formula: | C21 H17 Cl N4 O S2 |
| Smiles: | Cc1nnc(Sc2cc(C(NCCc3ccc(cc3)[Cl])=O)c3ccccc3n2)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.9811 |
| logD: | 4.9811 |
| logSw: | -4.9295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.585 |
| InChI Key: | UUZYABJRDONKAX-UHFFFAOYSA-N |