methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)thiophene-3-carboxylate
methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6466-0656 |
| Compound Name: | methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamido)thiophene-3-carboxylate |
| Molecular Weight: | 580.65 |
| Molecular Formula: | C26 H27 F3 N4 O4 S2 |
| Smiles: | CCN(CC)C(c1c(C)c(C(=O)OC)c(NC(C(C)Sc2nc(cc(C(F)(F)F)n2)c2ccccc2)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7335 |
| logD: | 4.0439 |
| logSw: | -5.5124 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.252 |
| InChI Key: | QVFXXOKSIDZVDT-HNNXBMFYSA-N |