N-tert-butyl-4-{2-cyclopropyl-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidin-4-yl}piperazine-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-{2-cyclopropyl-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidin-4-yl}piperazine-1-carboxamide
N-tert-butyl-4-{2-cyclopropyl-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidin-4-yl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V029-4980F |
| Compound Name: | N-tert-butyl-4-{2-cyclopropyl-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidin-4-yl}piperazine-1-carboxamide |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C25 H34 F N5 O |
| Smiles: | CCc1c(Cc2ccc(cc2)F)c(nc(C2CC2)n1)N1CCN(CC1)C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.595 |
| logD: | 4.5088 |
| logSw: | -5.3791 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.135 |
| InChI Key: | ATGZXSWRUOXSIQ-UHFFFAOYSA-N |