N-[2,4-bis(4-ethylanilino)-6-methylpyrimidin-5-yl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[2,4-bis(4-ethylanilino)-6-methylpyrimidin-5-yl]-3-fluorobenzamide
N-[2,4-bis(4-ethylanilino)-6-methylpyrimidin-5-yl]-3-fluorobenzamide
Compound characteristics
| Compound ID: | F653-0090 |
| Compound Name: | N-[2,4-bis(4-ethylanilino)-6-methylpyrimidin-5-yl]-3-fluorobenzamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C28 H28 F N5 O |
| Smiles: | CCc1ccc(cc1)Nc1c(c(C)nc(Nc2ccc(CC)cc2)n1)NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0282 |
| logD: | 6.9084 |
| logSw: | -5.6481 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 60.681 |
| InChI Key: | JSFUVFSPYYEKPA-UHFFFAOYSA-N |