N-(3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
N-(3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | M183-1542 |
| Compound Name: | N-(3-methylphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | Cc1cccc(c1)NC(CN1C(c2ccccc2C(=N1)N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8975 |
| logD: | 2.8975 |
| logSw: | -3.3823 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.386 |
| InChI Key: | PQKHFYOLCVEFLU-UHFFFAOYSA-N |