9-ethyl-2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
9-ethyl-2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
9-ethyl-2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-6025 |
| Compound Name: | 9-ethyl-2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 373.39 |
| Molecular Formula: | C15 H15 N7 O3 S |
| Smiles: | CCc1c2c3nc(Cn4cc(c(n4)OC)[N+]([O-])=O)nn3cnc2sc1C |
| Stereo: | ACHIRAL |
| logP: | 2.5805 |
| logD: | 2.58 |
| logSw: | -2.57 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 88.045 |
| InChI Key: | VHSNMGVLMFBZRK-UHFFFAOYSA-N |