3,3'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylene]bis(4-hydroxy-2H-1-benzopyran-2-one)
Chemical Structure Depiction of
3,3'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylene]bis(4-hydroxy-2H-1-benzopyran-2-one)
3,3'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylene]bis(4-hydroxy-2H-1-benzopyran-2-one)
Compound characteristics
| Compound ID: | 1804-0052 |
| Compound Name: | 3,3'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylene]bis(4-hydroxy-2H-1-benzopyran-2-one) |
| Molecular Weight: | 501.41 |
| Molecular Formula: | C26 H15 N O10 |
| Smiles: | C1Oc2cc(C(C3=C(c4ccccc4OC3=O)O)C3=C(c4ccccc4OC3=O)O)c(cc2O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0424 |
| logD: | 0.1867 |
| logSw: | -3.6984 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.877 |
| InChI Key: | IHCOPGSWOIAIJD-UHFFFAOYSA-N |