3-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
3-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | F797-0378 |
| Compound Name: | 3-(8-bromo-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide |
| Molecular Weight: | 429.27 |
| Molecular Formula: | C19 H17 Br N4 O3 |
| Smiles: | Cc1ccc(CNC(CCN2C=Nc3c4cc(ccc4[nH]c3C2=O)[Br])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.6596 |
| logD: | 2.6596 |
| logSw: | -2.9911 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.01 |
| InChI Key: | CVQREWKJOLTWJW-UHFFFAOYSA-N |