N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y504-4994 |
| Compound Name: | N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 541.47 |
| Molecular Formula: | C23 H25 Br N8 O S |
| Smiles: | Cc1cc(C(NNC(Nc2c(C)nn(Cc3ccc(cc3)[Br])c2C)=S)=O)c2c(C)nn(C)c2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4388 |
| logD: | 2.4317 |
| logSw: | -3.1253 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.676 |
| InChI Key: | CIHOQWPZVOMGBE-UHFFFAOYSA-N |