N-(2H-1,3-benzodioxol-5-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | M183-1458 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Smiles: | C1CSCCN1C1c2ccccc2C(N(CC(Nc2ccc3c(c2)OCO3)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3707 |
| logD: | 2.3707 |
| logSw: | -3.1516 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.502 |
| InChI Key: | GLOZNJKBUCDDCI-UHFFFAOYSA-N |