N-tert-butyl-4-(4-{[4-(2-cyanophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-(4-{[4-(2-cyanophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide
N-tert-butyl-4-(4-{[4-(2-cyanophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V018-3482 |
| Compound Name: | N-tert-butyl-4-(4-{[4-(2-cyanophenyl)piperazin-1-yl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 478.6 |
| Molecular Formula: | C25 H34 N8 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)c2ccccc2C#N)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7365 |
| logD: | 0.7034 |
| logSw: | -2.6806 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.805 |
| InChI Key: | OIFWDSWESFEMNV-UHFFFAOYSA-N |