8-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Chemical Structure Depiction of
8-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
8-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | J099-0211 |
| Compound Name: | 8-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide |
| Molecular Weight: | 457.32 |
| Molecular Formula: | C22 H21 Br N2 O4 |
| Smiles: | COc1ccc(CCNC(C2=CN3CCc4cc(cc(C2=O)c34)[Br])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.9078 |
| logD: | 2.9078 |
| logSw: | -3.5027 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.764 |
| InChI Key: | FDIYCFKQWPEXMF-UHFFFAOYSA-N |