1-benzyl-3-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Chemical Structure Depiction of
1-benzyl-3-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
1-benzyl-3-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Compound characteristics
| Compound ID: | S579-0579 |
| Compound Name: | 1-benzyl-3-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one |
| Molecular Weight: | 381.52 |
| Molecular Formula: | C23 H31 N3 O2 |
| Smiles: | CCN1CCN(CC1)C(CC1=C2CCCCC2N(Cc2ccccc2)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3601 |
| logD: | 2.0649 |
| logSw: | -2.3309 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.91 |
| InChI Key: | QJWGEXLLTUNDFT-OAQYLSRUSA-N |