N-(2-methylpropyl)-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(2-methylpropyl)-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
N-(2-methylpropyl)-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V027-2665 |
| Compound Name: | N-(2-methylpropyl)-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 438.51 |
| Molecular Formula: | C21 H25 F3 N4 O S |
| Salt: | not_available |
| Smiles: | CC(C)CNC(c1ccc(CSc2nc(cc(n2)N2CCCC2)C(F)(F)F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.916 |
| logD: | 4.916 |
| logSw: | -4.6063 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.227 |
| InChI Key: | PSXGLKCTHGEFNZ-UHFFFAOYSA-N |