2-amino-4-(3,4-dimethoxyphenyl)-3-nitro-4H,5H-pyrano[3,2-c][1]benzopyran-5-one
Chemical Structure Depiction of
2-amino-4-(3,4-dimethoxyphenyl)-3-nitro-4H,5H-pyrano[3,2-c][1]benzopyran-5-one
2-amino-4-(3,4-dimethoxyphenyl)-3-nitro-4H,5H-pyrano[3,2-c][1]benzopyran-5-one
Compound characteristics
| Compound ID: | 8008-4806 |
| Compound Name: | 2-amino-4-(3,4-dimethoxyphenyl)-3-nitro-4H,5H-pyrano[3,2-c][1]benzopyran-5-one |
| Molecular Weight: | 396.35 |
| Molecular Formula: | C20 H16 N2 O7 |
| Smiles: | COc1ccc(cc1OC)C1C2=C(c3ccccc3OC2=O)OC(=C1[N+]([O-])=O)N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1491 |
| logD: | 2.1491 |
| logSw: | -2.9831 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.204 |
| InChI Key: | LNSLZEFGXCUFTH-HNNXBMFYSA-N |