N-(2-methylpropyl)-2-({4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]-4H-pyran-3-yl}oxy)acetamide
Chemical Structure Depiction of
N-(2-methylpropyl)-2-({4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]-4H-pyran-3-yl}oxy)acetamide
N-(2-methylpropyl)-2-({4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]-4H-pyran-3-yl}oxy)acetamide
Compound characteristics
| Compound ID: | IB05-0514 |
| Compound Name: | N-(2-methylpropyl)-2-({4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]-4H-pyran-3-yl}oxy)acetamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C22 H29 N3 O4 |
| Smiles: | CC(C)CNC(COC1=COC(CN2CCN(CC2)c2ccccc2)=CC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7 |
| logD: | 1.69 |
| logSw: | -2.84 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.35 |
| InChI Key: | QNFZJOUTKPNLFY-UHFFFAOYSA-N |