5-[(4-fluorophenyl)methyl]-3-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Chemical Structure Depiction of
5-[(4-fluorophenyl)methyl]-3-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
5-[(4-fluorophenyl)methyl]-3-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Compound characteristics
| Compound ID: | C880-2196 |
| Compound Name: | 5-[(4-fluorophenyl)methyl]-3-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one |
| Molecular Weight: | 497.53 |
| Molecular Formula: | C27 H24 F N7 O2 |
| Smiles: | C1CN(CCN1C(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccc(cc1)F)=O)=O)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.0505 |
| logD: | 3.0505 |
| logSw: | -2.9552 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.087 |
| InChI Key: | OVXCKAWPEIGQGP-UHFFFAOYSA-N |