methyl 2-{[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]amino}-4,5-dimethoxybenzoate
Chemical Structure Depiction of
methyl 2-{[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]amino}-4,5-dimethoxybenzoate
methyl 2-{[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]amino}-4,5-dimethoxybenzoate
Compound characteristics
| Compound ID: | Y600-1822 |
| Compound Name: | methyl 2-{[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]amino}-4,5-dimethoxybenzoate |
| Molecular Weight: | 375.42 |
| Molecular Formula: | C20 H25 N O6 |
| Smiles: | CC(=C1C(CC(C)(C)CC1=O)=O)Nc1cc(c(cc1C(=O)OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5567 |
| logD: | -2.8641 |
| logSw: | -2.833 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.613 |
| InChI Key: | ZDXPMAWQKQYYHI-UHFFFAOYSA-N |