N-benzyl-4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide
N-benzyl-4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V021-6405 |
| Compound Name: | N-benzyl-4-(4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 505.6 |
| Molecular Formula: | C27 H32 F N7 O2 |
| Salt: | not_available |
| Smiles: | C(c1ccccc1)NC(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)c2ccccc2F)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1103 |
| logD: | 0.986 |
| logSw: | -2.7372 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.654 |
| InChI Key: | NKEFJGQGNRCIMH-UHFFFAOYSA-N |