1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(1-ethyl-1H-indol-3-yl)-3-(3-methoxyphenyl)propan-1-one
Chemical Structure Depiction of
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(1-ethyl-1H-indol-3-yl)-3-(3-methoxyphenyl)propan-1-one
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(1-ethyl-1H-indol-3-yl)-3-(3-methoxyphenyl)propan-1-one
Compound characteristics
| Compound ID: | V008-0508 |
| Compound Name: | 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(1-ethyl-1H-indol-3-yl)-3-(3-methoxyphenyl)propan-1-one |
| Molecular Weight: | 525.65 |
| Molecular Formula: | C32 H35 N3 O4 |
| Salt: | not_available |
| Smiles: | CCn1cc(C(CC(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)c2cccc(c2)OC)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7314 |
| logD: | 4.3872 |
| logSw: | -4.6453 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.016 |
| InChI Key: | LEGCLYQYOGBJNZ-HHHXNRCGSA-N |