9-(3-bromo-4-methylphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Chemical Structure Depiction of
9-(3-bromo-4-methylphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
9-(3-bromo-4-methylphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Compound characteristics
| Compound ID: | C276-0708 |
| Compound Name: | 9-(3-bromo-4-methylphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one |
| Molecular Weight: | 374.23 |
| Molecular Formula: | C18 H16 Br N O3 |
| Smiles: | Cc1ccc(cc1[Br])C1CC(Nc2cc3c(cc12)OCCO3)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5023 |
| logD: | 2.5022 |
| logSw: | -2.9885 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.611 |
| InChI Key: | CKYKFCXKSOHWRB-LBPRGKRZSA-N |