4-chloro-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-chloro-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
4-chloro-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0360 |
| Compound Name: | 4-chloro-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 529.96 |
| Molecular Formula: | C18 H26 Cl N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | C1CC(CN(CCS(N2CCNCC2)(=O)=O)C(c2ccc(cc2)[Cl])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5031 |
| logD: | 0.1584 |
| logSw: | -2.7275 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.648 |
| InChI Key: | WUNJMPOYLDCDKT-QGZVFWFLSA-N |