3-[(2S)-1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[(2S)-1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl]quinazolin-4(3H)-one
3-[(2S)-1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-8673 |
| Compound Name: | 3-[(2S)-1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl]quinazolin-4(3H)-one |
| Molecular Weight: | 430.43 |
| Molecular Formula: | C22 H21 F3 N4 O2 |
| Smiles: | C[C@@H](C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)N1C=Nc2ccccc2C1=O |
| Stereo: | ABSOLUTE |
| logP: | 2.4411 |
| logD: | 2.4411 |
| logSw: | -2.929 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.026 |
| InChI Key: | NBGCWIUSRLOIBJ-HNNXBMFYSA-N |