8-fluoro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
8-fluoro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
8-fluoro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F796-0301 |
| Compound Name: | 8-fluoro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 423.42 |
| Molecular Formula: | C22 H19 F2 N5 O2 |
| Smiles: | C1CN(CCN1C(CN1C=Nc2c3cc(ccc3[nH]c2C1=O)F)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 1.9331 |
| logD: | 1.9331 |
| logSw: | -2.7209 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.95 |
| InChI Key: | OAXWIYSFUPMKQB-UHFFFAOYSA-N |