[4-({[4-(methoxymethyl)-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Chemical Structure Depiction of
[4-({[4-(methoxymethyl)-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
[4-({[4-(methoxymethyl)-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Compound characteristics
| Compound ID: | V003-0598 |
| Compound Name: | [4-({[4-(methoxymethyl)-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone |
| Molecular Weight: | 587.66 |
| Molecular Formula: | C29 H32 F3 N5 O3 S |
| Salt: | not_available |
| Smiles: | COCc1cc(nc(n1)SCc1ccc(cc1)C(N1CCOCC1)=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.5051 |
| logD: | 4.5049 |
| logSw: | -4.4335 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.912 |
| InChI Key: | QPCNVEKPPYXCFU-UHFFFAOYSA-N |