4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyrazin-6-yl)-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}butanamide
Chemical Structure Depiction of
4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyrazin-6-yl)-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}butanamide
4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyrazin-6-yl)-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}butanamide
Compound characteristics
| Compound ID: | IB06-6219 |
| Compound Name: | 4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyrazin-6-yl)-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}butanamide |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C21 H22 N6 O3 |
| Smiles: | CC(C)n1c2ccccc2nc1CNC(CCCN1C(c2c(C1=O)nccn2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.29 |
| logD: | 0.15 |
| logSw: | -1.98 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 144.98 |
| InChI Key: | UWAWAJPYRFYUAS-UHFFFAOYSA-N |