4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-phenyl-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-phenyl-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-phenyl-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | Y070-1522 |
| Compound Name: | 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-phenyl-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 428.44 |
| Molecular Formula: | C25 H20 N2 O5 |
| Smiles: | C(c1cccnc1)N1C(C(=C(C1=O)O)C(c1ccc2c(c1)OCCO2)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8683 |
| logD: | 1.8647 |
| logSw: | -2.1546 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.168 |
| InChI Key: | YZHDIHROSSVJNH-QFIPXVFZSA-N |