4-{[(4-bromophenyl)methyl]sulfanyl}-2-(3-methoxyphenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
4-{[(4-bromophenyl)methyl]sulfanyl}-2-(3-methoxyphenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
4-{[(4-bromophenyl)methyl]sulfanyl}-2-(3-methoxyphenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1496 |
| Compound Name: | 4-{[(4-bromophenyl)methyl]sulfanyl}-2-(3-methoxyphenyl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 443.32 |
| Molecular Formula: | C19 H15 Br N4 O2 S |
| Smiles: | COc1cccc(c1)C1=NC2=CC(NN2C(=N1)SCc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.918 |
| logD: | 3.918 |
| logSw: | -4.08 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.477 |
| InChI Key: | LPXWPNYGXARDIA-UHFFFAOYSA-N |