1-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one
Chemical Structure Depiction of
1-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one
1-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one
Compound characteristics
| Compound ID: | C618-0773 |
| Compound Name: | 1-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one |
| Molecular Weight: | 436.9 |
| Molecular Formula: | C23 H21 Cl N4 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(cnn1CC(N1CCN(CC1)c1ccc(cc1)[Cl])=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.5337 |
| logD: | 3.5336 |
| logSw: | -3.8846 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.111 |
| InChI Key: | SFYJPEZIFRBEOU-UHFFFAOYSA-N |