2-(4-bromophenyl)-2-oxoethyl 4-(2,6-dimethylanilino)-4-oxobutanoate
Chemical Structure Depiction of
2-(4-bromophenyl)-2-oxoethyl 4-(2,6-dimethylanilino)-4-oxobutanoate
2-(4-bromophenyl)-2-oxoethyl 4-(2,6-dimethylanilino)-4-oxobutanoate
Compound characteristics
| Compound ID: | 1606-0072 |
| Compound Name: | 2-(4-bromophenyl)-2-oxoethyl 4-(2,6-dimethylanilino)-4-oxobutanoate |
| Molecular Weight: | 418.29 |
| Molecular Formula: | C20 H20 Br N O4 |
| Smiles: | Cc1cccc(C)c1NC(CCC(=O)OCC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5092 |
| logD: | 3.5092 |
| logSw: | -3.5341 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.502 |
| InChI Key: | MPLMXLFUGBGLQR-UHFFFAOYSA-N |