4-methoxy-N-(2-methylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methoxy-N-(2-methylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-methoxy-N-(2-methylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L127-0707 |
| Compound Name: | 4-methoxy-N-(2-methylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 533.58 |
| Molecular Formula: | C17 H29 N3 O5 S2 |
| Salt: | CF3COOH |
| Smiles: | CC(C)CN(CCS(N1CCNCC1)(=O)=O)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2795 |
| logD: | 0.9349 |
| logSw: | -2.2947 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.973 |
| InChI Key: | UNAMJHNUSJGABY-UHFFFAOYSA-N |