N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-0299 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide |
| Molecular Weight: | 477.65 |
| Molecular Formula: | C25 H27 N5 O S2 |
| Smiles: | CCN(CCCNC(c1cc(nc2ccccc12)Sc1nnc(C)s1)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.6016 |
| logD: | 5.5732 |
| logSw: | -5.5459 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.575 |
| InChI Key: | GIKIFQIDPHYSDN-UHFFFAOYSA-N |