methyl 4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutanoate
methyl 4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutanoate
Compound characteristics
| Compound ID: | 8014-1838 |
| Compound Name: | methyl 4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutanoate |
| Molecular Weight: | 359.42 |
| Molecular Formula: | C20 H25 N O5 |
| Smiles: | CC1(C)CC(=C(C(CCC(=O)OC)=O)C(C1)=O)Nc1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.0874 |
| logD: | 0.258 |
| logSw: | -3.5517 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.158 |
| InChI Key: | SRNMTKWBDJHRBZ-UHFFFAOYSA-N |