9-(3-bromo-4-fluorophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Chemical Structure Depiction of
9-(3-bromo-4-fluorophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
9-(3-bromo-4-fluorophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Compound characteristics
| Compound ID: | C276-0510 |
| Compound Name: | 9-(3-bromo-4-fluorophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one |
| Molecular Weight: | 378.2 |
| Molecular Formula: | C17 H13 Br F N O3 |
| Smiles: | C1C(c2ccc(c(c2)[Br])F)c2cc3c(cc2NC1=O)OCCO3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1489 |
| logD: | 2.1488 |
| logSw: | -3.1559 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.611 |
| InChI Key: | KCEHOMWKUYBDFB-JTQLQIEISA-N |