N-(5-{[(5,7-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
Chemical Structure Depiction of
N-(5-{[(5,7-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
N-(5-{[(5,7-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | G751-3898 |
| Compound Name: | N-(5-{[(5,7-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Smiles: | Cc1cc(C)c2C(C=C(CSc3nnc(NC(c4cccc(c4)OC)=O)s3)Nc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3149 |
| logD: | 5.3018 |
| logSw: | -5.3909 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.302 |
| InChI Key: | ISMGHNHVYZZOJK-UHFFFAOYSA-N |