2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-fluorophenyl)methyl]acetamide
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F521-0221 |
| Compound Name: | 2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-fluorophenyl)methyl]acetamide |
| Molecular Weight: | 462.44 |
| Molecular Formula: | C24 H19 F N4 O5 |
| Smiles: | C(c1ccc(cc1)F)NC(CN1C(N(Cc2ccc3c(c2)OCO3)C(c2c1cccn2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4797 |
| logD: | 2.4797 |
| logSw: | -2.8885 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.763 |
| InChI Key: | VNYIKSJHSJYFJF-UHFFFAOYSA-N |