N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Compound characteristics
| Compound ID: | L690-1355 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{8-fluoro-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide |
| Molecular Weight: | 476.42 |
| Molecular Formula: | C23 H17 F N6 O5 |
| Smiles: | Cc1nc(CN2C=Nc3c4cc(ccc4n(CC(Nc4ccc5c(c4)OCO5)=O)c3C2=O)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.4994 |
| logD: | 2.4993 |
| logSw: | -3.0022 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.421 |
| InChI Key: | GBCBMFCBDLTQIE-UHFFFAOYSA-N |