3-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
3-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0773 |
| Compound Name: | 3-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 565.65 |
| Molecular Formula: | C22 H37 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(c1)C(N(CCCN1CCN(C)CC1)CCS(N1CCNCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2096 |
| logD: | -1.0609 |
| logSw: | -2.2209 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.431 |
| InChI Key: | PYZVUDZOPOZPCK-UHFFFAOYSA-N |