2-({6-[(4-benzylpiperazin-1-yl)methyl]-4-oxo-4H-pyran-3-yl}oxy)-N-(2-methylpropyl)acetamide
Chemical Structure Depiction of
2-({6-[(4-benzylpiperazin-1-yl)methyl]-4-oxo-4H-pyran-3-yl}oxy)-N-(2-methylpropyl)acetamide
2-({6-[(4-benzylpiperazin-1-yl)methyl]-4-oxo-4H-pyran-3-yl}oxy)-N-(2-methylpropyl)acetamide
Compound characteristics
| Compound ID: | IB07-8853 |
| Compound Name: | 2-({6-[(4-benzylpiperazin-1-yl)methyl]-4-oxo-4H-pyran-3-yl}oxy)-N-(2-methylpropyl)acetamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C23 H31 N3 O4 |
| Smiles: | CC(C)CNC(COC1=COC(CN2CCN(CC2)Cc2ccccc2)=CC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.38 |
| logD: | 1.16 |
| logSw: | -2.53 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.48 |
| InChI Key: | GLKJLFXFUGZCDZ-UHFFFAOYSA-N |