N-[(3-bromophenyl)methyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide
N-[(3-bromophenyl)methyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C799-0563 |
| Compound Name: | N-[(3-bromophenyl)methyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide |
| Molecular Weight: | 482.4 |
| Molecular Formula: | C22 H20 Br N5 O S |
| Smiles: | Cc1c2c(c(nn1)SCC(NCc1cccc(c1)[Br])=O)nn(c1ccccc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 3.8204 |
| logD: | 3.8204 |
| logSw: | -4.1613 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.216 |
| InChI Key: | DCWHJQQTFJAKSS-UHFFFAOYSA-N |