3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]propan-1-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]propan-1-one
3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]propan-1-one
Compound characteristics
| Compound ID: | Y044-5156 |
| Compound Name: | 3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]propan-1-one |
| Molecular Weight: | 423.82 |
| Molecular Formula: | C19 H17 Cl F3 N5 O |
| Smiles: | C(C(c1ccc(cc1)[Cl])n1cccc1)C(N1CCn2c(C1)nnc2C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0001 |
| logD: | 3.0001 |
| logSw: | -3.6702 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.588 |
| InChI Key: | WPNWUNQQRIZKAN-HNNXBMFYSA-N |