N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | M183-1459 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[1-oxo-4-(thiomorpholin-4-yl)phthalazin-2(1H)-yl]acetamide |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | C1CSCCN1C1c2ccccc2C(N(CC(Nc2ccc3c(c2)OCCO3)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5101 |
| logD: | 1.5101 |
| logSw: | -2.665 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.21 |
| InChI Key: | ZRTIGPYHHUYUDI-UHFFFAOYSA-N |