N-(2-chloro-4-methylphenyl)-2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
N-(2-chloro-4-methylphenyl)-2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G199-3496 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 415.86 |
| Molecular Formula: | C18 H14 Cl N5 O3 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CSC1=NC(c2ccco2)=NC2=CC(NN12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5461 |
| logD: | 2.546 |
| logSw: | -3.2995 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.963 |
| InChI Key: | BCWXWDYQOJMTAM-UHFFFAOYSA-N |