N-(4-bromo-3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
N-(4-bromo-3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | M183-1494 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide |
| Molecular Weight: | 473.39 |
| Molecular Formula: | C21 H21 Br N4 O2 S |
| Smiles: | Cc1cc(ccc1[Br])NC(CN1C(c2ccccc2C(=N1)N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7122 |
| logD: | 3.7121 |
| logSw: | -3.8961 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.386 |
| InChI Key: | FVMDVNAUCZNKFU-UHFFFAOYSA-N |