6,7-dimethoxy-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-3,4-dihydroquinolin-2(1H)-one
Chemical Structure Depiction of
6,7-dimethoxy-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-3,4-dihydroquinolin-2(1H)-one
6,7-dimethoxy-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-3,4-dihydroquinolin-2(1H)-one
Compound characteristics
| Compound ID: | 8014-6836 |
| Compound Name: | 6,7-dimethoxy-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-3,4-dihydroquinolin-2(1H)-one |
| Molecular Weight: | 372.33 |
| Molecular Formula: | C18 H16 N2 O7 |
| Smiles: | COc1cc2C(CC(Nc2cc1OC)=O)c1cc2c(cc1[N+]([O-])=O)OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.968 |
| logD: | 1.9679 |
| logSw: | -2.7613 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.245 |
| InChI Key: | ATBNZGVSEHYHFM-SECBINFHSA-N |