2-methyl-5-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethoxy)-4H-pyran-4-one
Chemical Structure Depiction of
2-methyl-5-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethoxy)-4H-pyran-4-one
2-methyl-5-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethoxy)-4H-pyran-4-one
Compound characteristics
| Compound ID: | IB06-0662 |
| Compound Name: | 2-methyl-5-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethoxy)-4H-pyran-4-one |
| Molecular Weight: | 432.47 |
| Molecular Formula: | C22 H28 N2 O7 |
| Smiles: | CC1=CC(C(=CO1)OCC(N1CCN(CC1)Cc1ccc(c(c1OC)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.71 |
| logD: | 0.64 |
| logSw: | -1.52 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 116.77 |
| InChI Key: | XIHLODQVXZXPEE-UHFFFAOYSA-N |