N-(5-{[(5,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
N-(5-{[(5,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
N-(5-{[(5,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | G751-4045 |
| Compound Name: | N-(5-{[(5,8-dimethyl-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(C)c2c1C(C=C(CSc1nnc(NC(c3ccccc3)=O)s1)N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8829 |
| logD: | 4.8378 |
| logSw: | -4.6778 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.507 |
| InChI Key: | XFMZZXBRUTUCEI-UHFFFAOYSA-N |