5-(hydroxymethyl)-8-methyl-2-[(4-sulfamoylphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carbothioamide
Chemical Structure Depiction of
5-(hydroxymethyl)-8-methyl-2-[(4-sulfamoylphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carbothioamide
5-(hydroxymethyl)-8-methyl-2-[(4-sulfamoylphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carbothioamide
Compound characteristics
| Compound ID: | C200-3113 |
| Compound Name: | 5-(hydroxymethyl)-8-methyl-2-[(4-sulfamoylphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carbothioamide |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C17 H16 N4 O4 S2 |
| Smiles: | Cc1c2c(C=C(/C(=N/c3ccc(cc3)S(N)(=O)=O)O2)C(N)=S)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | -0.0098 |
| logD: | -0.0115 |
| logSw: | -1.9086 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 112.515 |
| InChI Key: | NPDYEEKQDWNWHL-UHFFFAOYSA-N |