5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide
5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | V024-8247 |
| Compound Name: | 5-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]furan-2-carboxamide |
| Molecular Weight: | 603.07 |
| Molecular Formula: | C28 H26 Cl F3 N6 O2 S |
| Salt: | not_available |
| Smiles: | C(CNC(c1ccc(CSc2nc(cc(n2)N2CCN(CC2)c2ccccc2[Cl])C(F)(F)F)o1)=O)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 6.1175 |
| logD: | 6.1173 |
| logSw: | -6.2518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.775 |
| InChI Key: | AEINDRAVKSJHLQ-UHFFFAOYSA-N |