N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(3-methylphenyl)pyrimidin-2-yl]amino}benzamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(3-methylphenyl)pyrimidin-2-yl]amino}benzamide
N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(3-methylphenyl)pyrimidin-2-yl]amino}benzamide
Compound characteristics
| Compound ID: | L369-0030 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-{[5-(3-methylphenyl)pyrimidin-2-yl]amino}benzamide |
| Molecular Weight: | 424.46 |
| Molecular Formula: | C25 H20 N4 O3 |
| Smiles: | Cc1cccc(c1)c1cnc(Nc2cccc(c2)C(Nc2ccc3c(c2)OCO3)=O)nc1 |
| Stereo: | ACHIRAL |
| logP: | 5.19 |
| logD: | 5.189 |
| logSw: | -4.9241 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.835 |
| InChI Key: | FWBXYCKCTNLNOE-UHFFFAOYSA-N |