2-(4-methylphenyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(4-methylphenyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1)
2-(4-methylphenyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | L126-0019 |
Compound Name: | 2-(4-methylphenyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 564.62 |
Molecular Formula: | C22 H34 N4 O4 S |
Salt: | CF3COOH |
Smiles: | Cc1ccc(CC(N(CCCN2CCCC2=O)CCS(N2CCNCC2)(=O)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | -0.0789 |
logD: | -0.4236 |
logSw: | -2.1015 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.957 |
InChI Key: | YJRLLFYPVSZDME-UHFFFAOYSA-N |