N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(4-fluorophenyl)pyrimidin-2-yl]amino}benzamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(4-fluorophenyl)pyrimidin-2-yl]amino}benzamide
N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(4-fluorophenyl)pyrimidin-2-yl]amino}benzamide
Compound characteristics
| Compound ID: | L369-0180 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(4-fluorophenyl)pyrimidin-2-yl]amino}benzamide |
| Molecular Weight: | 428.42 |
| Molecular Formula: | C24 H17 F N4 O3 |
| Smiles: | C1Oc2ccc(cc2O1)NC(c1cccc(c1)Nc1ncc(cn1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9051 |
| logD: | 4.9041 |
| logSw: | -4.9263 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.835 |
| InChI Key: | WWVOHPAVLMAVGR-UHFFFAOYSA-N |