{4-[(4-benzylpiperazin-1-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
{4-[(4-benzylpiperazin-1-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone--hydrogen chloride (1/1)
{4-[(4-benzylpiperazin-1-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | Y021-2249 |
Compound Name: | {4-[(4-benzylpiperazin-1-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone--hydrogen chloride (1/1) |
Molecular Weight: | 488.07 |
Molecular Formula: | C30 H33 N3 O |
Salt: | HCl |
Smiles: | CC1(C)C=C(CN2CCN(CC2)Cc2ccccc2)c2ccccc2N1C(c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.8488 |
logD: | 4.4834 |
logSw: | -4.5745 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 21.5971 |
InChI Key: | UKMNFHCTUVEYPC-UHFFFAOYSA-N |