5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxyethyl)-4-(3-phenylprop-2-enoyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxyethyl)-4-(3-phenylprop-2-enoyl)-1,5-dihydro-2H-pyrrol-2-one
5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxyethyl)-4-(3-phenylprop-2-enoyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8010-2053 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxyethyl)-4-(3-phenylprop-2-enoyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 393.39 |
| Molecular Formula: | C22 H19 N O6 |
| Smiles: | C(CO)N1C(C(=C(C1=O)O)C(/C=C/c1ccccc1)=O)c1ccc2c(c1)OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5048 |
| logD: | 2.4902 |
| logSw: | -2.7496 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.356 |
| InChI Key: | VNKYYWXEQZHMKJ-FQEVSTJZSA-N |