4-butoxy-N-[(3-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-butoxy-N-[(3-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
4-butoxy-N-[(3-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | F594-1015 |
Compound Name: | 4-butoxy-N-[(3-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 551.61 |
Molecular Formula: | C26 H35 N3 O3 |
Salt: | CF3COOH |
Smiles: | CCCCOc1ccc(cc1)C(N(CCC(N1CCNCC1)=O)Cc1cccc(C)c1)=O |
Stereo: | ACHIRAL |
logP: | 3.1868 |
logD: | 2.3588 |
logSw: | -3.2097 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.927 |
InChI Key: | KOKOWYYLOFXAHV-UHFFFAOYSA-N |