(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[5-(trifluoromethyl)pyridin-2-yl]butanamide
Chemical Structure Depiction of
(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[5-(trifluoromethyl)pyridin-2-yl]butanamide
(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[5-(trifluoromethyl)pyridin-2-yl]butanamide
Compound characteristics
| Compound ID: | Y043-6140 |
| Compound Name: | (2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[5-(trifluoromethyl)pyridin-2-yl]butanamide |
| Molecular Weight: | 438.43 |
| Molecular Formula: | C19 H17 F3 N4 O3 S |
| Smiles: | CSCC[C@@H](C(Nc1ccc(cn1)C(F)(F)F)=O)N1C(c2ccccc2NC1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.606 |
| logD: | 3.6057 |
| logSw: | -3.7269 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.473 |
| InChI Key: | PBIJZICXXGDFNM-AWEZNQCLSA-N |