N-(3-acetamidophenyl)-8-bromo-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Chemical Structure Depiction of
N-(3-acetamidophenyl)-8-bromo-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
N-(3-acetamidophenyl)-8-bromo-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | J099-0269 |
| Compound Name: | N-(3-acetamidophenyl)-8-bromo-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide |
| Molecular Weight: | 426.27 |
| Molecular Formula: | C20 H16 Br N3 O3 |
| Smiles: | CC(Nc1cccc(c1)NC(C1=CN2CCc3cc(cc(C1=O)c23)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0927 |
| logD: | 3.0925 |
| logSw: | -3.4888 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.602 |
| InChI Key: | ISFOOZHFUNHOAE-UHFFFAOYSA-N |