4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-[3-(dimethylamino)propyl]-5-(2-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-[3-(dimethylamino)propyl]-5-(2-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-[3-(dimethylamino)propyl]-5-(2-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | Y070-1496 |
| Compound Name: | 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-[3-(dimethylamino)propyl]-5-(2-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 440.47 |
| Molecular Formula: | C24 H25 F N2 O5 |
| Smiles: | CN(C)CCCN1C(C(=C(C1=O)O)C(c1ccc2c(c1)OCCO2)=O)c1ccccc1F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8947 |
| logD: | -0.054 |
| logSw: | -2.6592 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.766 |
| InChI Key: | IEGAXJLXQHDSFR-OAQYLSRUSA-N |