[2-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazol-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
[2-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazol-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
[2-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazol-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V007-4972 |
| Compound Name: | [2-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazol-4-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 637.71 |
| Molecular Formula: | C30 H26 F3 N7 O2 S2 |
| Salt: | not_available |
| Smiles: | COc1ccccc1n1c(c2cccnc2)nnc1SCc1nc(cs1)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.933 |
| logD: | 4.9288 |
| logSw: | -4.5285 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.969 |
| InChI Key: | DVZQSPYRPIVQFR-UHFFFAOYSA-N |