N-[3-(methylsulfanyl)phenyl]-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
N-[3-(methylsulfanyl)phenyl]-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F424-0784 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C18 H15 N5 O2 S3 |
| Smiles: | CSc1cccc(c1)NC(CSC1=NNC(c2cc(c3cccs3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6117 |
| logD: | 3.6101 |
| logSw: | -3.7695 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.482 |
| InChI Key: | ZYWVFNGACVPFPL-UHFFFAOYSA-N |