4-methyl-N-(5-{[(6-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
4-methyl-N-(5-{[(6-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
4-methyl-N-(5-{[(6-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | G751-3125 |
| Compound Name: | 4-methyl-N-(5-{[(6-methyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C21 H18 N4 O2 S2 |
| Smiles: | Cc1ccc(cc1)C(Nc1nnc(SCC2=CC(c3cc(C)ccc3N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.268 |
| logD: | 5.2118 |
| logSw: | -5.0921 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.759 |
| InChI Key: | XYJLEFDASNFQKA-UHFFFAOYSA-N |