N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Compound characteristics
| Compound ID: | E016-0497 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C23 H26 N6 O2 S |
| Smiles: | CCN(CCCNC(CN1C(c2cc(c3cccs3)nn2C=N1)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.7436 |
| logD: | 2.7113 |
| logSw: | -3.0393 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.466 |
| InChI Key: | KMWIUALMAOZGAB-UHFFFAOYSA-N |