N-[(3,4-diethoxyphenyl)methyl]-3-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}benzamide
Chemical Structure Depiction of
N-[(3,4-diethoxyphenyl)methyl]-3-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}benzamide
N-[(3,4-diethoxyphenyl)methyl]-3-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}benzamide
Compound characteristics
| Compound ID: | L369-0546 |
| Compound Name: | N-[(3,4-diethoxyphenyl)methyl]-3-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}benzamide |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C28 H27 F N4 O3 |
| Smiles: | CCOc1ccc(CNC(c2cccc(c2)Nc2ncc(cn2)c2cccc(c2)F)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.8806 |
| logD: | 4.8806 |
| logSw: | -4.4437 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.462 |
| InChI Key: | IACRVSHXDDWIFH-UHFFFAOYSA-N |