2-[(4-nitro-1H-pyrazol-1-yl)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(4-nitro-1H-pyrazol-1-yl)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(4-nitro-1H-pyrazol-1-yl)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-0525 |
| Compound Name: | 2-[(4-nitro-1H-pyrazol-1-yl)methyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 341.35 |
| Molecular Formula: | C14 H11 N7 O2 S |
| Smiles: | C1Cc2c3c4nc(Cn5cc(cn5)[N+]([O-])=O)nn4C=Nc3sc2C1 |
| Stereo: | ACHIRAL |
| logP: | 1.4864 |
| logD: | 1.4861 |
| logSw: | -1.8622 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 83.091 |
| InChI Key: | LZUUOXAYGDNSGY-UHFFFAOYSA-N |