2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Compound characteristics
Compound ID: | Y206-6366 |
Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide |
Molecular Weight: | 385.51 |
Molecular Formula: | C22 H31 N3 O3 |
Smiles: | C1CCC(CCNC(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)=CC1 |
Stereo: | ACHIRAL |
logP: | 2.5993 |
logD: | 1.7677 |
logSw: | -2.9384 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.132 |
InChI Key: | AFVIWMVQMDYXFX-UHFFFAOYSA-N |