2-{[2-(4-chlorophenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}-N-[(3-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}-N-[(3-methylphenyl)methyl]acetamide
2-{[2-(4-chlorophenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}-N-[(3-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | E860-1037 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}-N-[(3-methylphenyl)methyl]acetamide |
| Molecular Weight: | 451.98 |
| Molecular Formula: | C23 H22 Cl N5 O S |
| Smiles: | Cc1cccc(CNC(CSc2c3c(c(C)nn2)c(C)n(c2ccc(cc2)[Cl])n3)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4723 |
| logD: | 4.4723 |
| logSw: | -4.7343 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.216 |
| InChI Key: | SXGBHYKACJPUDN-UHFFFAOYSA-N |