N-{3-[methyl(phenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[methyl(phenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
N-{3-[methyl(phenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-0131 |
| Compound Name: | N-{3-[methyl(phenyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide |
| Molecular Weight: | 449.6 |
| Molecular Formula: | C23 H23 N5 O S2 |
| Smiles: | Cc1nnc(Sc2cc(C(NCCCN(C)c3ccccc3)=O)c3ccccc3n2)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3013 |
| logD: | 4.2964 |
| logSw: | -4.0871 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.79 |
| InChI Key: | RGHHZHDOGZYYGM-UHFFFAOYSA-N |