methyl 4-{2,5-dioxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]pyrrolidin-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{2,5-dioxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]pyrrolidin-1-yl}benzoate
methyl 4-{2,5-dioxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]pyrrolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | 8008-9966 |
| Compound Name: | methyl 4-{2,5-dioxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]pyrrolidin-1-yl}benzoate |
| Molecular Weight: | 395.42 |
| Molecular Formula: | C20 H21 N5 O4 |
| Smiles: | COC(c1ccc(cc1)N1C(CC(C1=O)N1CCN(CC1)c1ncccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1123 |
| logD: | 1.1123 |
| logSw: | -1.7742 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.784 |
| InChI Key: | KFOWHELIARFOSQ-INIZCTEOSA-N |