ethyl 1-{3-[1-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1H-benzo[g]indol-2-yl]propanoyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[1-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1H-benzo[g]indol-2-yl]propanoyl}piperidine-4-carboxylate
ethyl 1-{3-[1-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1H-benzo[g]indol-2-yl]propanoyl}piperidine-4-carboxylate
Compound characteristics
Compound ID: | V011-7970 |
Compound Name: | ethyl 1-{3-[1-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1H-benzo[g]indol-2-yl]propanoyl}piperidine-4-carboxylate |
Molecular Weight: | 500.59 |
Molecular Formula: | C30 H32 N2 O5 |
Smiles: | CCOC(C1CCN(CC1)C(CCc1cc2CCc3ccccc3c2n1c1ccc2c(c1)OCO2)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.0939 |
logD: | 5.0939 |
logSw: | -4.8075 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 55.694 |
InChI Key: | XUGZKQFDKHSBTJ-UHFFFAOYSA-N |