1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one
Chemical Structure Depiction of
1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one
1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one
Compound characteristics
| Compound ID: | C618-0649 |
| Compound Name: | 1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-8-methyl[1]benzopyrano[4,3-c]pyrazol-4(1H)-one |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C25 H25 N3 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(cnn1CC(N1CCC(CC1)Cc1ccccc1)=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.1529 |
| logD: | 4.1529 |
| logSw: | -4.2226 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.579 |
| InChI Key: | PHLKJLJNCBXIOU-UHFFFAOYSA-N |