N-{3-[benzyl(methyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
N-{3-[benzyl(methyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-0302 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide |
| Molecular Weight: | 463.62 |
| Molecular Formula: | C24 H25 N5 O S2 |
| Smiles: | Cc1nnc(Sc2cc(C(NCCCN(C)Cc3ccccc3)=O)c3ccccc3n2)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.344 |
| logD: | 2.9029 |
| logSw: | -4.1361 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.679 |
| InChI Key: | YMRQJQQOGHFIDE-UHFFFAOYSA-N |