4-fluoro-N-(3-methoxypropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-fluoro-N-(3-methoxypropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-fluoro-N-(3-methoxypropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L127-0643 |
| Compound Name: | 4-fluoro-N-(3-methoxypropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 537.55 |
| Molecular Formula: | C16 H26 F N3 O5 S2 |
| Salt: | CF3COOH |
| Smiles: | COCCCN(CCS(N1CCNCC1)(=O)=O)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3047 |
| logD: | -0.0399 |
| logSw: | -2.3084 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.751 |
| InChI Key: | NKPTXKXVZIZODN-UHFFFAOYSA-N |