2-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one--hydrogen chloride (1/1)
2-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y021-2219 |
| Compound Name: | 2-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 528.05 |
| Molecular Formula: | C28 H33 N3 O5 |
| Salt: | HCl |
| Smiles: | CC1=CC(C)(C)N(C(CN2CCN(CC2)C(C2COc3ccccc3O2)=O)=O)c2ccc(cc12)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4706 |
| logD: | 3.4706 |
| logSw: | -3.8789 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.238 |
| InChI Key: | RDHIOUTYEFKTEM-VWLOTQADSA-N |