4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-(2-fluorophenyl)-3-hydroxy-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)-5-(2-fluorophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-(2-fluorophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | Y070-1523 |
| Compound Name: | 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-(2-fluorophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 446.43 |
| Molecular Formula: | C25 H19 F N2 O5 |
| Smiles: | C(c1cccnc1)N1C(C(=C(C1=O)O)C(c1ccc2c(c1)OCCO2)=O)c1ccccc1F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0506 |
| logD: | 2.047 |
| logSw: | -2.4889 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.168 |
| InChI Key: | UESRJSOMTMLJAA-JOCHJYFZSA-N |