4,4,6-trimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 3-bromobenzoate
Chemical Structure Depiction of
4,4,6-trimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 3-bromobenzoate
4,4,6-trimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 3-bromobenzoate
Compound characteristics
| Compound ID: | Y020-0485 |
| Compound Name: | 4,4,6-trimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 3-bromobenzoate |
| Molecular Weight: | 426.26 |
| Molecular Formula: | C21 H16 Br N O4 |
| Smiles: | CC1=CC(C)(C)N2C(C(c3cc(cc1c23)OC(c1cccc(c1)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.378 |
| logD: | 4.378 |
| logSw: | -4.5682 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.217 |
| InChI Key: | JGPWMEPYEKBITC-UHFFFAOYSA-N |