2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y500-8757 |
| Compound Name: | 2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 359.36 |
| Molecular Formula: | C14 H13 N7 O3 S |
| Smiles: | Cc1c2c3nc(Cn4cc(c(n4)OC)[N+]([O-])=O)nn3cnc2sc1C |
| Stereo: | ACHIRAL |
| logP: | 2.0925 |
| logD: | 2.0875 |
| logSw: | -2.0195 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 88.045 |
| InChI Key: | RSOINQGGDXYPKV-UHFFFAOYSA-N |