2-{7-[4-(2-hydroxyethyl)piperazin-1-yl]-7-oxoheptyl}-1H-isoindole-1,3(2H)-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-{7-[4-(2-hydroxyethyl)piperazin-1-yl]-7-oxoheptyl}-1H-isoindole-1,3(2H)-dione--hydrogen chloride (1/1)
2-{7-[4-(2-hydroxyethyl)piperazin-1-yl]-7-oxoheptyl}-1H-isoindole-1,3(2H)-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4782-0587 |
| Compound Name: | 2-{7-[4-(2-hydroxyethyl)piperazin-1-yl]-7-oxoheptyl}-1H-isoindole-1,3(2H)-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 423.94 |
| Molecular Formula: | C21 H29 N3 O4 |
| Salt: | HCl |
| Smiles: | C(CCCN1C(c2ccccc2C1=O)=O)CCC(N1CCN(CC1)CCO)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2837 |
| logD: | 1.2317 |
| logSw: | -1.9094 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.308 |
| InChI Key: | NCGUYRIPVDCJKF-UHFFFAOYSA-N |