{4-[(cyclohex-3-en-1-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(cyclohex-3-en-1-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
{4-[(cyclohex-3-en-1-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4964-1262 |
| Compound Name: | {4-[(cyclohex-3-en-1-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 464.51 |
| Molecular Formula: | C21 H30 N2 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CCN(CC1)CC1CCC=CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6679 |
| logD: | 2.4533 |
| logSw: | -2.9491 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.597 |
| InChI Key: | IHBIFAFLCFSOQP-MRXNPFEDSA-N |