(morpholin-4-yl){4-[({5-(propan-2-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-(propan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
(morpholin-4-yl){4-[({5-(propan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone
Compound characteristics
| Compound ID: | V029-5592 |
| Compound Name: | (morpholin-4-yl){4-[({5-(propan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]phenyl}methanone |
| Molecular Weight: | 490.55 |
| Molecular Formula: | C24 H25 F3 N4 O2 S |
| Smiles: | CC(C)c1nnc(n1c1cccc(c1)C(F)(F)F)SCc1ccc(cc1)C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8517 |
| logD: | 3.8512 |
| logSw: | -3.973 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.541 |
| InChI Key: | PUCZBTMAYPJIIW-UHFFFAOYSA-N |