3-({4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1)
Chemical Structure Depiction of
3-({4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1)
3-({4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1)
Compound characteristics
Compound ID: | 3381-0618 |
Compound Name: | 3-({4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1) |
Molecular Weight: | 455.51 |
Molecular Formula: | C22 H27 N3 O2 |
Salt: | HOOCCOOH |
Smiles: | COc1ccc(CN2CCN(CC2)Cc2c[nH]c3ccccc23)cc1OC |
Stereo: | ACHIRAL |
logP: | 2.7126 |
logD: | 1.5733 |
logSw: | -3.0055 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 32.643 |
InChI Key: | LOOUNTMPJOAVBS-UHFFFAOYSA-N |