N-(2H-1,3-benzodioxol-5-yl)-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide
N-(2H-1,3-benzodioxol-5-yl)-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide
Compound characteristics
| Compound ID: | F725-0339 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide |
| Molecular Weight: | 428.42 |
| Molecular Formula: | C24 H17 F N4 O3 |
| Smiles: | C1Oc2ccc(cc2O1)NC(c1cccc(c1)Nc1cc(c2ccc(cc2)F)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4286 |
| logD: | 5.3966 |
| logSw: | -5.9708 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.463 |
| InChI Key: | IYMUCRMTUDYEBD-UHFFFAOYSA-N |