2-(4-methoxyphenyl)-3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile
Chemical Structure Depiction of
2-(4-methoxyphenyl)-3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile
2-(4-methoxyphenyl)-3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile
Compound characteristics
| Compound ID: | 8020-3701 |
| Compound Name: | 2-(4-methoxyphenyl)-3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile |
| Molecular Weight: | 341.36 |
| Molecular Formula: | C19 H19 N O5 |
| Smiles: | COc1ccc(cc1)C(C#N)C(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7607 |
| logD: | 2.757 |
| logSw: | -3.2868 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.283 |
| InChI Key: | ITXWNGCYHJQWFP-OAHLLOKOSA-N |