5-({[4-(4-benzylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
5-({[4-(4-benzylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]furan-2-carboxamide
5-({[4-(4-benzylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | V025-2301 |
| Compound Name: | 5-({[4-(4-benzylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 568.62 |
| Molecular Formula: | C28 H27 F3 N6 O2 S |
| Salt: | not_available |
| Smiles: | C(c1cccnc1)NC(c1ccc(CSc2nc(cc(n2)N2CCN(CC2)Cc2ccccc2)C(F)(F)F)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8707 |
| logD: | 4.7636 |
| logSw: | -4.6115 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.489 |
| InChI Key: | XCUDMOVGOHQZOZ-UHFFFAOYSA-N |