N-[(furan-2-yl)methyl]-5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carboxamide
N-[(furan-2-yl)methyl]-5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | V024-9900 |
| Compound Name: | N-[(furan-2-yl)methyl]-5-{[(4-methyl-6-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-2-yl)sulfanyl]methyl}furan-2-carboxamide |
| Molecular Weight: | 557.59 |
| Molecular Formula: | C27 H26 F3 N5 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1ccc(C(NCc2ccco2)=O)o1)N1CCN(CC1)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.2375 |
| logD: | 6.2373 |
| logSw: | -5.6623 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.246 |
| InChI Key: | SXIKBSMPTDXGTH-UHFFFAOYSA-N |