8-bromo-3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
8-bromo-3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
8-bromo-3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F796-0418 |
| Compound Name: | 8-bromo-3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 484.33 |
| Molecular Formula: | C22 H19 Br F N5 O2 |
| Smiles: | C1CN(CCN1C(CN1C=Nc2c3cc(ccc3[nH]c2C1=O)[Br])=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 2.6163 |
| logD: | 2.6163 |
| logSw: | -3.1481 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.649 |
| InChI Key: | XOQZTOATOZCDRO-UHFFFAOYSA-N |