8,9-dimethyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
8,9-dimethyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
8,9-dimethyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-8529 |
| Compound Name: | 8,9-dimethyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 343.36 |
| Molecular Formula: | C14 H13 N7 O2 S |
| Smiles: | Cc1c2c3nc(Cn4cc(c(C)n4)[N+]([O-])=O)nn3cnc2sc1C |
| Stereo: | ACHIRAL |
| logP: | 1.8746 |
| logD: | 1.8656 |
| logSw: | -1.9912 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.321 |
| InChI Key: | FSHZVFDPWIWXPL-UHFFFAOYSA-N |