2-(2,4-dimethylphenyl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methoxy-1,4-dihydro[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
Chemical Structure Depiction of
2-(2,4-dimethylphenyl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methoxy-1,4-dihydro[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
2-(2,4-dimethylphenyl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methoxy-1,4-dihydro[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
Compound characteristics
| Compound ID: | C201-0817 |
| Compound Name: | 2-(2,4-dimethylphenyl)-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methoxy-1,4-dihydro[1]benzopyrano[2,3-c]pyrazol-3(2H)-one |
| Molecular Weight: | 542.61 |
| Molecular Formula: | C31 H31 F N4 O4 |
| Smiles: | Cc1ccc(c(C)c1)N1C(C2Cc3cccc(c3OC=2N1CC(N1CCN(CC1)c1ccc(cc1)F)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0568 |
| logD: | 5.0568 |
| logSw: | -4.8682 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.993 |
| InChI Key: | HYVUJBGFKTVFKG-UHFFFAOYSA-N |