9-(3-bromo-4-ethoxy-5-methoxyphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Chemical Structure Depiction of
9-(3-bromo-4-ethoxy-5-methoxyphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
9-(3-bromo-4-ethoxy-5-methoxyphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Compound characteristics
| Compound ID: | C276-0008 |
| Compound Name: | 9-(3-bromo-4-ethoxy-5-methoxyphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one |
| Molecular Weight: | 434.29 |
| Molecular Formula: | C20 H20 Br N O5 |
| Smiles: | CCOc1c(cc(cc1[Br])C1CC(Nc2cc3c(cc12)OCCO3)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4681 |
| logD: | 2.468 |
| logSw: | -2.9104 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.538 |
| InChI Key: | TXGBWTRZSLWBSP-LBPRGKRZSA-N |