2-[(1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
2-[(1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | Y021-2215 |
| Compound Name: | 2-[(1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 497.6 |
| Molecular Formula: | C29 H31 N5 O3 |
| Smiles: | CC1=CC(C)(C)N(C(c2ccccc2)=O)c2ccc(cc12)OCC(N1CCN(CC1)c1ncccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0146 |
| logD: | 4.0146 |
| logSw: | -4.2666 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.567 |
| InChI Key: | BROKWSBMJMFIRB-UHFFFAOYSA-N |