3-(4-ethylpiperazine-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-ethylpiperazine-1-carbonyl)-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
3-(4-ethylpiperazine-1-carbonyl)-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
Compound characteristics
| Compound ID: | E207-1347 |
| Compound Name: | 3-(4-ethylpiperazine-1-carbonyl)-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C18 H22 N4 O3 S |
| Smiles: | CCN1CCN(CC1)C(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6209 |
| logD: | 0.4431 |
| logSw: | -2.2898 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.272 |
| InChI Key: | AJAIWIFBNHESNZ-UHFFFAOYSA-N |