2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-bromo-1-(3-hydroxyphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-bromo-1-(3-hydroxyphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-bromo-1-(3-hydroxyphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | 6959-1550 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-bromo-1-(3-hydroxyphenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 506.31 |
| Molecular Formula: | C25 H16 Br N O6 |
| Smiles: | C(c1ccc2c(c1)OCO2)N1C(C2=C(C1=O)Oc1ccc(cc1C2=O)[Br])c1cccc(c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5847 |
| logD: | 4.5724 |
| logSw: | -4.173 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.465 |
| InChI Key: | MSSYLYPCJUZCEA-JOCHJYFZSA-N |