N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-ethyl-2-(3-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-ethyl-2-(3-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-ethyl-2-(3-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]acetamide
Compound characteristics
| Compound ID: | P196-0731 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-ethyl-2-(3-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]acetamide |
| Molecular Weight: | 409.42 |
| Molecular Formula: | C22 H20 F N3 O4 |
| Smiles: | CCC1=CC(N(CC(Nc2ccc3c(c2)OCCO3)=O)C(c2cccc(c2)F)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4633 |
| logD: | 2.4633 |
| logSw: | -3.0184 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.063 |
| InChI Key: | SPLHGDZLQCZNMD-UHFFFAOYSA-N |