N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-(6-cyclopropyl-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-(6-cyclopropyl-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-(6-cyclopropyl-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y508-8791 |
| Compound Name: | N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-(6-cyclopropyl-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 513 |
| Molecular Formula: | C23 H22 Cl F N8 O S |
| Smiles: | Cc1c2c(cc(C3CC3)nc2n(C)n1)C(NNC(Nc1c(cn(Cc2cccc(c2)F)n1)[Cl])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6057 |
| logD: | 2.6415 |
| logSw: | -4.0602 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.156 |
| InChI Key: | FDLBCHWARWRISM-UHFFFAOYSA-N |