N-[3-(morpholin-4-yl)propyl]-4-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)quinazolin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-[3-(morpholin-4-yl)propyl]-4-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)quinazolin-3(4H)-yl]butanamide
N-[3-(morpholin-4-yl)propyl]-4-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)quinazolin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | K284-3924 |
| Compound Name: | N-[3-(morpholin-4-yl)propyl]-4-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)quinazolin-3(4H)-yl]butanamide |
| Molecular Weight: | 591.65 |
| Molecular Formula: | C28 H32 F3 N5 O4 S |
| Smiles: | C(CC(NCCCN1CCOCC1)=O)CN1C(=Nc2ccccc2C1=O)SCC(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6073 |
| logD: | 1.1838 |
| logSw: | -2.5861 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.405 |
| InChI Key: | KTXKOHYBYMJIOZ-UHFFFAOYSA-N |