3-(8-fluoro-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(2-fluorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-(8-fluoro-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(2-fluorophenyl)methyl]propanamide
3-(8-fluoro-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(2-fluorophenyl)methyl]propanamide
Compound characteristics
| Compound ID: | C200-7774 |
| Compound Name: | 3-(8-fluoro-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(2-fluorophenyl)methyl]propanamide |
| Molecular Weight: | 382.37 |
| Molecular Formula: | C20 H16 F2 N4 O2 |
| Smiles: | C(CN1C=Nc2c3cc(ccc3[nH]c2C1=O)F)C(NCc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3212 |
| logD: | 2.3212 |
| logSw: | -2.8542 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.747 |
| InChI Key: | ZQTVAKQHJCCPSJ-UHFFFAOYSA-N |