11-(butan-2-yl)-3-hexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Chemical Structure Depiction of
11-(butan-2-yl)-3-hexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
11-(butan-2-yl)-3-hexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Compound characteristics
| Compound ID: | IB09-4855 |
| Compound Name: | 11-(butan-2-yl)-3-hexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one |
| Molecular Weight: | 377.49 |
| Molecular Formula: | C22 H27 N5 O |
| Smiles: | CCCCCCN1C=Nc2c(C1=O)c1c(nc3ccccc3n1)n2C(C)CC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.15 |
| logD: | 5.15 |
| logSw: | -5.82 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 76.72 |
| InChI Key: | GURNXYSIDIJSSD-HNNXBMFYSA-N |