(4-ethylpiperazin-1-yl){2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
Chemical Structure Depiction of
(4-ethylpiperazin-1-yl){2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
(4-ethylpiperazin-1-yl){2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
Compound characteristics
| Compound ID: | V029-3801 |
| Compound Name: | (4-ethylpiperazin-1-yl){2-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone |
| Molecular Weight: | 489.56 |
| Molecular Formula: | C24 H26 F3 N5 O S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1ccccc1CSc1nnc(C)n1c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4992 |
| logD: | 3.323 |
| logSw: | -3.7578 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.946 |
| InChI Key: | NCKFRVLRCMRYOA-UHFFFAOYSA-N |