3-(2-{4-[(4-methylphenyl)methyl]piperazin-1-yl}-2-oxoethyl)-1-(propan-2-yl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Chemical Structure Depiction of
3-(2-{4-[(4-methylphenyl)methyl]piperazin-1-yl}-2-oxoethyl)-1-(propan-2-yl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
3-(2-{4-[(4-methylphenyl)methyl]piperazin-1-yl}-2-oxoethyl)-1-(propan-2-yl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Compound characteristics
| Compound ID: | S579-0391 |
| Compound Name: | 3-(2-{4-[(4-methylphenyl)methyl]piperazin-1-yl}-2-oxoethyl)-1-(propan-2-yl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one |
| Molecular Weight: | 409.57 |
| Molecular Formula: | C25 H35 N3 O2 |
| Smiles: | CC(C)N1C2CCCCC2=C(CC(N2CCN(CC2)Cc2ccc(C)cc2)=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1934 |
| logD: | 3.0985 |
| logSw: | -3.1265 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.906 |
| InChI Key: | CRHZWWQYRIOLKM-HSZRJFAPSA-N |