5-({[4-(4-acetylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)furan-2-carboxamide
Chemical Structure Depiction of
5-({[4-(4-acetylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)furan-2-carboxamide
5-({[4-(4-acetylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | V027-3221 |
| Compound Name: | 5-({[4-(4-acetylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(propan-2-yl)furan-2-carboxamide |
| Molecular Weight: | 471.5 |
| Molecular Formula: | C20 H24 F3 N5 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)NC(c1ccc(CSc2nc(cc(n2)N2CCN(CC2)C(C)=O)C(F)(F)F)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6827 |
| logD: | 3.6827 |
| logSw: | -3.9371 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.872 |
| InChI Key: | IWSXHXZRCLZALM-UHFFFAOYSA-N |