2-{[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]methyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]methyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]methyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-1573 |
| Compound Name: | 2-{[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]methyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 374.41 |
| Molecular Formula: | C17 H16 F2 N6 S |
| Smiles: | Cc1cc(C(F)F)nn1Cc1nc2c3c4CCCCc4sc3N=Cn2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4017 |
| logD: | 2.401 |
| logSw: | -2.2844 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 48.767 |
| InChI Key: | ZFKNHZGPOVXGDP-UHFFFAOYSA-N |