2-(2H-1,3-benzodioxol-5-yl)-4-(2-fluoroanilino)-N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-4-(2-fluoroanilino)-N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-4-(2-fluoroanilino)-N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V021-2223 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-4-(2-fluoroanilino)-N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C24 H24 F N5 O3 |
| Smiles: | CN1CCC(CC1)NC(c1cnc(c2ccc3c(c2)OCO3)nc1Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6531 |
| logD: | 1.2347 |
| logSw: | -3.8113 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.645 |
| InChI Key: | OIMAIRKOCOWQPF-UHFFFAOYSA-N |