N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | M183-1443 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C21 H21 Cl N4 O3 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(c2ccccc2C(=N1)N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0482 |
| logD: | 3.0481 |
| logSw: | -3.5195 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.017 |
| InChI Key: | TTWHOXYRCWUKON-UHFFFAOYSA-N |