3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
Chemical Structure Depiction of
3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
Compound characteristics
| Compound ID: | E207-1420 |
| Compound Name: | 3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C24 H24 N4 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.757 |
| logD: | 1.757 |
| logSw: | -2.5836 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.822 |
| InChI Key: | DQCVLCBVPRWRBM-UHFFFAOYSA-N |