N-{2-[benzyl(propan-2-yl)amino]ethyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{2-[benzyl(propan-2-yl)amino]ethyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
N-{2-[benzyl(propan-2-yl)amino]ethyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-0306 |
| Compound Name: | N-{2-[benzyl(propan-2-yl)amino]ethyl}-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: | CC(C)N(CCNC(c1cc(nc2ccccc12)Sc1nnc(C)s1)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0019 |
| logD: | 4.5253 |
| logSw: | -4.7488 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.182 |
| InChI Key: | RDAGTJZEAJYENA-UHFFFAOYSA-N |