(4,5,6,7-tetrahydro-1-benzothiophen-2-yl){4-[6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(4,5,6,7-tetrahydro-1-benzothiophen-2-yl){4-[6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]piperazin-1-yl}methanone
(4,5,6,7-tetrahydro-1-benzothiophen-2-yl){4-[6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | T404-0499 |
| Compound Name: | (4,5,6,7-tetrahydro-1-benzothiophen-2-yl){4-[6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 435.47 |
| Molecular Formula: | C20 H20 F3 N5 O S |
| Smiles: | C1CCc2c(C1)cc(C(N1CCN(CC1)c1nnc3ccc(cn13)C(F)(F)F)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.8431 |
| logD: | 3.8431 |
| logSw: | -3.9581 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.13 |
| InChI Key: | XPHFFUSNZNMLBM-UHFFFAOYSA-N |