2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-6407 |
| Compound Name: | 2-{4-[(benzyloxy)acetyl]piperazin-1-yl}-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 520.61 |
| Molecular Formula: | C28 H33 F N6 O3 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(NC(=N1)N1CCN(CC1)C(COCc1ccccc1)=O)=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 1.9509 |
| logD: | 0.8267 |
| logSw: | -2.3987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.418 |
| InChI Key: | SMYKIAFAGGQYRD-UHFFFAOYSA-N |