2-(3,4-dimethoxyphenyl)-3-methyl-1,4-dioxo-6,7,8,9-tetrahydro-5H-1lambda~5~,4lambda~5~-cyclohepta[b]pyrazine
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-3-methyl-1,4-dioxo-6,7,8,9-tetrahydro-5H-1lambda~5~,4lambda~5~-cyclohepta[b]pyrazine
2-(3,4-dimethoxyphenyl)-3-methyl-1,4-dioxo-6,7,8,9-tetrahydro-5H-1lambda~5~,4lambda~5~-cyclohepta[b]pyrazine
Compound characteristics
| Compound ID: | 5074-0118 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-3-methyl-1,4-dioxo-6,7,8,9-tetrahydro-5H-1lambda~5~,4lambda~5~-cyclohepta[b]pyrazine |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C18 H22 N2 O4 |
| Smiles: | Cc1c(c2ccc(c(c2)OC)OC)[n+](c2CCCCCc2[n+]1[O-])[O-] |
| Stereo: | ACHIRAL |
| logP: | 2.8651 |
| logD: | 2.8651 |
| logSw: | -3.0443 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.558 |
| InChI Key: | XXGNLOXJXBUFIJ-UHFFFAOYSA-N |