N-(adamantan-1-yl)-4-[5-benzyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-[5-benzyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazine-1-carboxamide
N-(adamantan-1-yl)-4-[5-benzyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V009-9472 |
| Compound Name: | N-(adamantan-1-yl)-4-[5-benzyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 539.7 |
| Molecular Formula: | C33 H38 F N5 O |
| Smiles: | Cc1c(Cc2ccccc2)c(nc(c2cccc(c2)F)n1)N1CCN(CC1)C(NC12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.8136 |
| logD: | 7.7619 |
| logSw: | -5.7789 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.524 |
| InChI Key: | DZDGSODNHBRSFE-UHFFFAOYSA-N |