5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(pyridin-4-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(pyridin-4-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(pyridin-4-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8020-7147 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(pyridin-4-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 444.44 |
| Molecular Formula: | C25 H20 N2 O6 |
| Smiles: | COc1cccc(c1)C(C1C(c2ccc3c(c2)OCO3)N(Cc2ccncc2)C(C=1O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7817 |
| logD: | 2.7595 |
| logSw: | -2.7785 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.914 |
| InChI Key: | BONOOJHOOPLSID-QFIPXVFZSA-N |