N-[2-(1H-benzimidazol-2-yl)ethyl]-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-(1H-benzimidazol-2-yl)ethyl]-2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-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: | G199-3470 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 435.46 |
| Molecular Formula: | C20 H17 N7 O3 S |
| Smiles: | C(CNC(CSC1=NC(c2ccco2)=NC2=CC(NN12)=O)=O)c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.156 |
| logD: | 1.1425 |
| logSw: | -2.0187 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 103.106 |
| InChI Key: | FIHTUQMJIWHBDW-UHFFFAOYSA-N |