3-(3,5-dimethylpiperidine-1-carbonyl)-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
Chemical Structure Depiction of
3-(3,5-dimethylpiperidine-1-carbonyl)-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
3-(3,5-dimethylpiperidine-1-carbonyl)-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione
Compound characteristics
Compound ID: | E207-1342 |
Compound Name: | 3-(3,5-dimethylpiperidine-1-carbonyl)-1-methyl-1,4-dihydro-5H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-5,5-dione |
Molecular Weight: | 373.47 |
Molecular Formula: | C19 H23 N3 O3 S |
Smiles: | CC1CC(C)CN(C1)C(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.339 |
logD: | 2.339 |
logSw: | -2.7767 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 59.602 |
InChI Key: | ZRCHZZGDOXXCLE-UHFFFAOYSA-N |