1-benzyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Chemical Structure Depiction of
1-benzyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
1-benzyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Compound characteristics
| Compound ID: | S579-0540 |
| Compound Name: | 1-benzyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,4,5,6,7,7a-hexahydro-2H-indol-2-one |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C22 H29 N3 O2 |
| Smiles: | CN1CCN(CC1)C(CC1=C2CCCCC2N(Cc2ccccc2)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0153 |
| logD: | 1.7892 |
| logSw: | -2.085 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.85 |
| InChI Key: | HGXPLDVMPQIRPJ-HXUWFJFHSA-N |