N-[(3,4-diethoxyphenyl)methyl]-3-{[2-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide
Chemical Structure Depiction of
N-[(3,4-diethoxyphenyl)methyl]-3-{[2-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide
N-[(3,4-diethoxyphenyl)methyl]-3-{[2-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide
Compound characteristics
| Compound ID: | F871-0400 |
| Compound Name: | N-[(3,4-diethoxyphenyl)methyl]-3-{[2-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C28 H27 F N4 O3 |
| Smiles: | CCOc1ccc(CNC(c2cccc(c2)Nc2ccnc(c3ccc(cc3)F)n2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 5.0209 |
| logD: | 4.9743 |
| logSw: | -4.6541 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.284 |
| InChI Key: | LMJUSLIQGOYCLI-UHFFFAOYSA-N |