N-(4-ethoxyphenyl)-2-fluoro-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-fluoro-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
N-(4-ethoxyphenyl)-2-fluoro-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | D433-1073 |
| Compound Name: | N-(4-ethoxyphenyl)-2-fluoro-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzamide |
| Molecular Weight: | 421.43 |
| Molecular Formula: | C22 H20 F N5 O3 |
| Smiles: | CCOc1ccc(cc1)N(Cc1nc2NC(C)=CC(n2n1)=O)C(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9513 |
| logD: | 0.2987 |
| logSw: | -3.5371 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.47 |
| InChI Key: | XDCPRSCWVBOWKL-UHFFFAOYSA-N |