1-methyl-3-{2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl}azepan-2-one
Chemical Structure Depiction of
1-methyl-3-{2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl}azepan-2-one
1-methyl-3-{2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl}azepan-2-one
Compound characteristics
Compound ID: | S581-0469 |
Compound Name: | 1-methyl-3-{2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl}azepan-2-one |
Molecular Weight: | 343.47 |
Molecular Formula: | C20 H29 N3 O2 |
Smiles: | Cc1ccccc1N1CCN(CC1)C(CC1CCCCN(C)C1=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.1159 |
logD: | 2.1158 |
logSw: | -2.3953 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 36.255 |
InChI Key: | XBCZVCNFGQLYET-QGZVFWFLSA-N |