2-amino-1-(3,5-dimethylphenyl)-N-[(4-methylphenyl)methyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Chemical Structure Depiction of
2-amino-1-(3,5-dimethylphenyl)-N-[(4-methylphenyl)methyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
2-amino-1-(3,5-dimethylphenyl)-N-[(4-methylphenyl)methyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | IB07-2008 |
| Compound Name: | 2-amino-1-(3,5-dimethylphenyl)-N-[(4-methylphenyl)methyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide |
| Molecular Weight: | 435.53 |
| Molecular Formula: | C27 H25 N5 O |
| Smiles: | Cc1ccc(CNC(c2c3c(nc4ccccc4n3)n(c3cc(C)cc(C)c3)c2N)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.34 |
| logD: | 5.34 |
| logSw: | -6.42 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.56 |
| InChI Key: | JAKPYLFEERYYLT-UHFFFAOYSA-N |