2-{[7-(4-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{[7-(4-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-[(furan-2-yl)methyl]acetamide
2-{[7-(4-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | G802-0430 |
| Compound Name: | 2-{[7-(4-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 399.4 |
| Molecular Formula: | C18 H14 F N5 O3 S |
| Smiles: | C(c1ccco1)NC(CSc1nnc2C(N(C=Cn12)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1969 |
| logD: | 1.1969 |
| logSw: | -2.0715 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.922 |
| InChI Key: | NQOJAZDMLSUWBV-UHFFFAOYSA-N |