3-(2H-1,3-benzodioxol-5-yl)-2-nitro-3H-naphtho[2,1-b]pyran
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-2-nitro-3H-naphtho[2,1-b]pyran
3-(2H-1,3-benzodioxol-5-yl)-2-nitro-3H-naphtho[2,1-b]pyran
Compound characteristics
| Compound ID: | 8012-5635 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-2-nitro-3H-naphtho[2,1-b]pyran |
| Molecular Weight: | 347.33 |
| Molecular Formula: | C20 H13 N O5 |
| Smiles: | C1Oc2ccc(cc2O1)C1C(=Cc2c(ccc3ccccc23)O1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9012 |
| logD: | 4.9012 |
| logSw: | -5.8365 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.523 |
| InChI Key: | FFBOMGRVEIJACO-FQEVSTJZSA-N |