N-cyclopropyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclopropyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-cyclopropyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | F482-0416 |
Compound Name: | N-cyclopropyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 495.52 |
Molecular Formula: | C18 H27 N3 O4 S |
Salt: | CF3COOH |
Smiles: | CCOc1ccc(cc1)S(N(CCC(N1CCNCC1)=O)C1CC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.0916 |
logD: | 0.2636 |
logSw: | -2.4006 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.411 |
InChI Key: | LLHUSMUGVNMPPE-UHFFFAOYSA-N |