N-cyclohexyl-2-(3,6-dicyclopropyl-1-methyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-cyclohexyl-2-(3,6-dicyclopropyl-1-methyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
N-cyclohexyl-2-(3,6-dicyclopropyl-1-methyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
Compound characteristics
Compound ID: | Y508-8795 |
Compound Name: | N-cyclohexyl-2-(3,6-dicyclopropyl-1-methyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide |
Molecular Weight: | 412.56 |
Molecular Formula: | C21 H28 N6 O S |
Smiles: | Cn1c2c(c(cc(C3CC3)n2)C(NNC(NC2CCCCC2)=S)=O)c(C2CC2)n1 |
Stereo: | ACHIRAL |
logP: | 4.2746 |
logD: | 3.1897 |
logSw: | -4.3659 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 72.727 |
InChI Key: | ATVLBMSHQVMQNK-UHFFFAOYSA-N |