N-(5-{[(8-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
Chemical Structure Depiction of
N-(5-{[(8-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
N-(5-{[(8-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | G751-4436 |
| Compound Name: | N-(5-{[(8-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide |
| Molecular Weight: | 458.94 |
| Molecular Formula: | C20 H15 Cl N4 O3 S2 |
| Smiles: | COc1cccc(c1)C(Nc1nnc(SCC2=CC(c3cccc(c3N2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8523 |
| logD: | 4.5917 |
| logSw: | -4.9347 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.05 |
| InChI Key: | FVIZDJVENBKYQE-UHFFFAOYSA-N |