2,4,5-trimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2,4,5-trimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
2,4,5-trimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0689 |
| Compound Name: | 2,4,5-trimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 579.68 |
| Molecular Formula: | C23 H39 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cc(C)c(cc1C)S(N(CCCN1CCN(C)CC1)CC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9442 |
| logD: | 0.1296 |
| logSw: | -2.1441 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.133 |
| InChI Key: | AMLHEJHZIXRZMV-UHFFFAOYSA-N |