N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Compound characteristics
| Compound ID: | T604-0344 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide |
| Molecular Weight: | 439.44 |
| Molecular Formula: | C23 H22 F N3 O5 |
| Smiles: | CC1=C(CCO)C(N(CC(Nc2ccc3c(c2)OCCO3)=O)C(c2ccc(cc2)F)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0628 |
| logD: | 1.0627 |
| logSw: | -2.1729 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.629 |
| InChI Key: | CCZVXRDOKMMXFX-UHFFFAOYSA-N |