N-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1)
N-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0075 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-(4-methylphenyl)-N-[2-(piperazine-1-sulfonyl)ethyl]acetamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 564.02 |
| Molecular Formula: | C22 H28 Cl N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(CC(N(CCS(N2CCNCC2)(=O)=O)Cc2ccccc2[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7178 |
| logD: | 2.3732 |
| logSw: | -3.4597 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.466 |
| InChI Key: | JUDMXQIAPBBTCV-UHFFFAOYSA-N |