4-(3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)-1-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-(3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)-1-methyl-1H-pyrazole-3-carboxylic acid
4-(3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)-1-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y502-6921 |
| Compound Name: | 4-(3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)-1-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 441.39 |
| Molecular Formula: | C17 H14 F3 N5 O4 S |
| Smiles: | Cn1cc(c(C(O)=O)n1)NC(CCSc1nc(cc(C(F)(F)F)n1)c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4019 |
| logD: | -2.8125 |
| logSw: | -2.1687 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.782 |
| InChI Key: | IPLBZHQPJGTJAO-UHFFFAOYSA-N |