(morpholin-4-yl){4-[({5-(pyridin-4-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
Chemical Structure Depiction of
(morpholin-4-yl){4-[({5-(pyridin-4-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
(morpholin-4-yl){4-[({5-(pyridin-4-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
Compound characteristics
| Compound ID: | V027-3863 |
| Compound Name: | (morpholin-4-yl){4-[({5-(pyridin-4-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone |
| Molecular Weight: | 525.55 |
| Molecular Formula: | C26 H22 F3 N5 O2 S |
| Salt: | not_available |
| Smiles: | C1COCCN1C(c1ccc(CSc2nnc(c3ccncc3)n2c2cccc(c2)C(F)(F)F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4423 |
| logD: | 3.4423 |
| logSw: | -3.7192 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.698 |
| InChI Key: | NNEIYCPVKVQTII-UHFFFAOYSA-N |