2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
Chemical Structure Depiction of
2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | 8298-0131 |
| Compound Name: | 2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C21 H17 N5 O3 S2 |
| Smiles: | CN1C(c2ccccc2C(CC(Nc2nnc(SCC(c3ccccc3)=O)s2)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8297 |
| logD: | 2.8287 |
| logSw: | -3.7565 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.08 |
| InChI Key: | QLTQZSNAZBJVEN-UHFFFAOYSA-N |