5-(3,4-dimethoxyphenyl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1H-pyrazole-3-carboxamide
5-(3,4-dimethoxyphenyl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y041-6268 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C22 H24 N6 O3 S |
| Smiles: | COc1ccc(cc1OC)c1cc(C(N[C@@H](CCSC)c2nnc3ccccn23)=O)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 2.2415 |
| logD: | 2.2415 |
| logSw: | -2.8128 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.643 |
| InChI Key: | GYSWVFMFSQAAQU-HNNXBMFYSA-N |