9-(4-methyl-3-nitrophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Chemical Structure Depiction of
9-(4-methyl-3-nitrophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
9-(4-methyl-3-nitrophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Compound characteristics
| Compound ID: | C276-0245 |
| Compound Name: | 9-(4-methyl-3-nitrophenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one |
| Molecular Weight: | 340.33 |
| Molecular Formula: | C18 H16 N2 O5 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C1CC(Nc2cc3c(cc12)OCCO3)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9096 |
| logD: | 1.9095 |
| logSw: | -2.7657 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.691 |
| InChI Key: | QTRPMMFYDUSLQY-LBPRGKRZSA-N |