methyl 4-{3-[4-(2-cyanoethyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{3-[4-(2-cyanoethyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate
methyl 4-{3-[4-(2-cyanoethyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | 8015-8557 |
| Compound Name: | methyl 4-{3-[4-(2-cyanoethyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate |
| Molecular Weight: | 370.41 |
| Molecular Formula: | C19 H22 N4 O4 |
| Smiles: | COC(c1ccc(cc1)N1C(CC(C1=O)N1CCN(CCC#N)CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.2126 |
| logD: | -0.2133 |
| logSw: | -1.3345 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.444 |
| InChI Key: | SYNKFPDNEUXASB-INIZCTEOSA-N |