4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-3-oxo-N-phenylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-3-oxo-N-phenylpiperazine-1-carboxamide
4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-3-oxo-N-phenylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | L740-0058 |
| Compound Name: | 4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-3-oxo-N-phenylpiperazine-1-carboxamide |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C21 H22 N4 O5 |
| Smiles: | [H]c1ccc(cc1)NC(N1CCN(CC(NCc2ccc3c(c2)OCO3)=O)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2445 |
| logD: | 1.2445 |
| logSw: | -2.3102 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.932 |
| InChI Key: | YEFYBAIPALQPSI-UHFFFAOYSA-N |