1-methyl-5,5-dioxo-N-[2-(4-sulfamoylphenyl)ethyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-5,5-dioxo-N-[2-(4-sulfamoylphenyl)ethyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
1-methyl-5,5-dioxo-N-[2-(4-sulfamoylphenyl)ethyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E207-1514 |
| Compound Name: | 1-methyl-5,5-dioxo-N-[2-(4-sulfamoylphenyl)ethyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C20 H20 N4 O5 S2 |
| Smiles: | Cn1c2c3ccccc3S(Cc2c(C(NCCc2ccc(cc2)S(N)(=O)=O)=O)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1924 |
| logD: | 0.1917 |
| logSw: | -2.2523 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 117.945 |
| InChI Key: | XMQXIEDTNWVUNW-UHFFFAOYSA-N |